data_1oqp_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 1oqp _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 . . . . . 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 121.162 0.506 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 . . . . . 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 . . . . . 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.069 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 . . . . . 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 121.002 0.429 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 121.622 0.725 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 . . . . . 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 14.5 m-30 . . . . . 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.163 0.506 . . . . 0.0 111.808 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 3.2 p90 . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 119.953 -0.07 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.369 0.604 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt . . . . . 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 . . . . . 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-O 121.148 0.499 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.532 0.285 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.037 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 119.824 -0.132 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 122.172 0.987 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 . . . . . 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 . . . . . 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.28 30.4 m-80 . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 . . . . . 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.483 0.659 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 119.704 -0.189 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 . . . . . 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.572 0.225 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.535 0.394 0 CA-C-O 120.955 0.407 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 11.4 p -70.19 -61.47 1.76 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.818 0.847 . . . . 0.0 109.401 177.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 56.57 -101.97 0.17 Allowed Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.159 1.361 . . . . 0.0 110.507 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -62.58 -52.04 64.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.43 66.23 7.93 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.808 0.843 . . . . 0.0 108.948 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -124.43 155.57 38.63 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 124.172 0.989 . . . . 0.0 111.312 -173.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.07 -30.21 1.04 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 127.255 2.222 . . . . 0.0 113.178 174.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -72.84 121.62 20.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -124.7 16.1 8.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.484 1.514 . . . . 0.0 110.796 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 46.3 p30 -111.1 -15.9 13.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.341 1.456 . . . . 0.0 111.926 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 61.53 29.78 18.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.399 1.88 . . . . 0.0 112.59 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.55 -6.86 15.25 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.59 0.756 . . . . 0.0 112.761 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER 77.92 12.16 1.88 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.733 1.613 . . . . 0.0 113.759 177.539 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -48.21 -47.99 35.24 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.08 0.552 . . . . 0.0 111.704 -174.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -44.63 -54.84 5.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.746 0.819 . . . . 0.0 111.211 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.85 -50.74 71.05 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.361 0.665 . . . . 0.0 109.579 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.36 -37.31 72.41 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.36 0.264 . . . . 0.0 111.53 -177.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt -74.39 -51.02 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.932 0.893 . . . . 0.0 109.727 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 2.5 m-30 -77.66 37.82 0.24 Allowed 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -83.75 60.88 6.01 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 120.658 -1.276 . . . . 0.0 108.68 -178.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.89 79.1 0.21 Allowed 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.855 1.262 . . . . 0.0 110.386 -171.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.49 -70.63 0.1 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.905 2.082 . . . . 0.0 108.472 -171.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.386 173.009 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 4.0 p -69.94 -68.91 0.38 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.986 0.914 . . . . 0.0 109.156 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 42.83 -129.07 5.23 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 125.501 1.524 . . . . 0.0 111.896 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -67.82 -16.22 64.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.107 0.963 . . . . 0.0 112.694 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -88.16 -69.26 0.71 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -177.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.4 t70 43.92 -137.11 0.41 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.086 0.955 . . . . 0.0 110.162 -169.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p -80.35 56.04 2.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.335 1.454 . . . . 0.0 109.73 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 -75.02 128.67 36.11 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -83.68 55.29 3.17 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 172.13 -57.33 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.111 1.765 . . . . 0.0 110.842 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 50.6 t0 79.6 57.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 127.385 2.274 . . . . 0.0 110.324 -171.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.65 14.82 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.366 1.066 . . . . 0.0 111.334 170.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER 75.57 -8.69 1.55 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 126.478 1.911 . . . . 0.0 114.713 -173.29 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.578 0.228 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.61 71.39 1.38 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.444 0.698 . . . . 0.0 109.965 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.8 mtm105 -42.41 -40.24 2.48 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.256 1.422 . . . . 0.0 111.805 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -29.56 -52.28 0.12 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.642 1.977 . . . . 0.0 112.431 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 64.5 tp -55.37 -46.24 76.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.24 0.616 . . . . 0.0 111.043 -177.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt -76.78 -47.89 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 1.7 m-30 -74.08 51.88 0.43 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -79.99 65.27 5.1 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 120.457 -1.402 . . . . 0.0 108.857 174.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -67.17 -36.41 81.74 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 171.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.22 53.89 0.84 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.138 0.975 . . . . 0.0 110.24 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.406 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.074 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.9 m -74.31 72.08 1.77 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 76.48 -57.88 3.34 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.19 161.62 8.57 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.54 0.736 . . . . 0.0 110.197 171.25 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.61 148.98 14.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.971 1.308 . . . . 0.0 110.509 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -50.83 -34.04 26.14 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.019 0.928 . . . . 0.0 113.115 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -43.27 -41.61 4.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.816 1.247 . . . . 0.0 112.263 172.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -68.06 132.2 46.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -116.01 -6.25 11.97 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.909 0.884 . . . . 0.0 112.163 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -111.99 -9.22 14.02 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.076 0.95 . . . . 0.0 112.934 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 27.9 t0 64.46 35.22 9.63 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.998 2.119 . . . . 0.0 112.98 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -88.88 -11.39 44.74 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 70.04 25.95 4.67 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.326 1.851 . . . . 0.0 112.462 -176.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -108.05 103.22 12.39 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.208 1.003 . . . . 0.0 108.36 175.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 63.77 6.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.718 0.807 . . . . 0.0 109.939 -170.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -30.04 -58.96 0.18 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.985 2.114 . . . . 0.0 113.926 -169.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 65.1 tp -51.08 -47.88 61.77 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.736 0.814 . . . . 0.0 112.07 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp -79.71 -45.84 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -177.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -71.43 62.95 0.37 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -170.11 -47.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.813 1.645 . . . . 0.0 108.452 -169.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.5 t70 46.29 -139.52 0.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.2 1.4 . . . . 0.0 111.389 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 69.09 -62.72 0.39 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.189 1.796 . . . . 0.0 110.944 -173.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.596 169.971 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.298 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.4 m -49.87 -40.62 43.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.632 1.173 . . . . 0.0 112.513 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -73.26 65.76 1.6 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -63.24 -49.26 74.85 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.784 0.834 . . . . 0.0 110.63 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.47 -68.92 0.37 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 t70 36.95 -135.48 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.078 2.151 . . . . 0.0 112.059 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p -73.47 -41.16 63.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.776 1.631 . . . . 0.0 109.449 172.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -78.65 105.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -73.69 -20.82 60.43 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.365 -0.35 . . . . 0.0 111.809 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -95.16 -33.3 12.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.998 0.519 . . . . 0.0 111.67 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 28.0 t0 74.59 42.72 0.28 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.269 2.628 . . . . 0.0 113.777 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -100.65 9.98 41.77 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.316 1.046 . . . . 0.0 112.174 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 76.44 -3.71 2.49 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 126.539 1.935 . . . . 0.0 113.945 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.2 pttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -76.83 62.85 2.12 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.257 1.023 . . . . 0.0 109.788 -175.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.68 64.5 6.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.084 0.954 . . . . 0.0 110.852 -173.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -103.56 -89.17 0.4 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 169.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 81.2 mt -125.08 174.6 7.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.65 -45.63 84.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 2.7 m-30 -75.66 36.14 0.13 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -73.44 -4.1 31.59 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.099 -1.0 . . . . 0.0 111.764 -171.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -44.33 -36.36 2.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 125.748 1.619 . . . . 0.0 110.359 169.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -69.17 72.8 0.29 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.856 0.462 . . . . 0.0 110.138 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.26 1.824 . . . . 0.0 111.04 174.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -71.28 65.5 0.41 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.089 1.356 . . . . 0.0 110.61 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -29.01 -66.62 0.09 OUTLIER Glycine 0 CA--C 1.529 0.932 0 C-N-CA 126.873 2.177 . . . . 0.0 114.811 -169.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -59.32 -50.88 72.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.402 0.681 . . . . 0.0 110.788 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -57.59 -50.9 71.59 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.364 0.666 . . . . 0.0 109.419 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.79 -48.48 81.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.201 0.601 . . . . 0.0 109.632 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m -54.86 -50.96 67.39 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.402 0.281 . . . . 0.0 110.37 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -77.28 105.56 8.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -80.47 -17.02 52.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.223 -0.418 . . . . 0.0 112.12 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -96.51 -28.9 14.19 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.431 0.56 . . . . 0.0 112.306 -172.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 t0 76.02 38.01 0.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.414 2.286 . . . . 0.0 113.562 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -94.71 -2.09 51.79 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.998 0.919 . . . . 0.0 112.522 169.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 71.21 32.82 2.13 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.894 1.278 . . . . 0.0 110.837 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.541 0.21 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.35 70.22 10.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 175.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.3 -45.43 4.21 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.109 0.964 . . . . 0.0 111.298 -177.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -44.06 -50.0 8.58 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.917 1.287 . . . . 0.0 111.388 178.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 75.3 mt -69.97 -23.88 63.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.971 0.508 . . . . 0.0 111.588 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm -81.66 -49.09 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -60.21 -26.58 66.5 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -29.04 3.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.0 0.92 . . . . 0.0 112.436 172.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -58.89 -23.09 60.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 51.4 tttp 53.03 40.34 31.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.796 1.238 . . . . 0.0 111.072 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.346 -1.312 . . . . 0.0 110.026 176.071 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 12.4 p -72.62 171.32 12.69 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.995 0.518 . . . . 0.0 109.895 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.38 -62.67 4.45 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -109.04 166.38 10.88 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.623 1.169 . . . . 0.0 109.89 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.01 70.43 2.02 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -39.16 -54.99 1.71 Allowed 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.976 1.711 . . . . 0.0 112.197 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -50.85 -48.4 60.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.672 0.789 . . . . 0.0 111.728 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -74.26 104.19 4.94 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -91.58 -11.69 36.49 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.86 0.464 . . . . 0.0 111.553 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -95.82 -20.58 18.71 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.918 0.487 . . . . 0.0 112.274 -169.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 75.91 33.14 0.62 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.611 1.964 . . . . 0.0 112.902 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 -84.54 -13.73 50.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.762 0.825 . . . . 0.0 111.788 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 65.29 39.0 5.55 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.913 1.285 . . . . 0.0 110.183 -171.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -45.41 -40.66 8.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.726 1.21 . . . . 0.0 112.457 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.4 mtp-105 -45.87 -41.91 11.89 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.33 -46.73 87.79 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.369 0.531 . . . . 0.0 110.059 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.02 -44.79 94.97 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.033 0.533 . . . . 0.0 109.625 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.56 -61.03 1.72 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 10.7 m-30 -60.9 -30.5 70.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -58.68 -29.75 66.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.547 0.612 . . . . 0.0 111.582 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -75.15 67.23 1.78 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.327 0.967 . . . . 0.0 110.05 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -73.62 73.44 1.48 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.13 0.972 . . . . 0.0 109.856 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 93.0 mttt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.207 -1.378 . . . . 0.0 110.946 175.278 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.4 m 69.91 -60.43 0.48 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.76 1.624 . . . . 0.0 110.398 -173.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.02 67.29 1.75 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -67.54 93.94 0.38 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.191 0.596 . . . . 0.0 109.604 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -72.29 61.19 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.128 0.971 . . . . 0.0 111.574 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -115.14 -75.52 0.59 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.204 1.402 . . . . 0.0 108.75 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m 51.37 26.07 2.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 112.841 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -84.83 112.9 20.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -11.62 23.49 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.134 0.974 . . . . 0.0 111.552 169.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -87.02 -15.17 39.46 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.26 1.024 . . . . 0.0 112.054 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.1 p30 59.26 15.13 4.04 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.824 2.45 . . . . 0.0 115.454 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -94.56 2.03 55.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.813 0.845 . . . . 0.0 112.042 175.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER 83.7 -15.35 0.62 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 127.647 2.379 . . . . 0.0 113.059 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.5 mttm . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -75.39 69.52 2.19 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.73 -24.85 24.06 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.262 1.025 . . . . 0.0 112.746 -173.294 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -44.38 -41.76 6.39 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.23 1.012 . . . . 0.0 111.729 170.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.78 -34.2 71.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.677 0.391 . . . . 0.0 111.062 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt -75.5 -49.08 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 14.5 m-30 -71.8 -43.19 66.08 Favored 'General case' 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 33.44 -112.98 0.05 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.092 1.757 . . . . 0.0 113.615 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -70.3 -57.03 5.32 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.03 154.04 33.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 169.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.186 -1.388 . . . . 0.0 109.918 -179.767 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 m -72.89 58.88 0.48 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.297 1.439 . . . . 0.0 111.92 -176.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -81.03 57.61 4.84 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 123.956 0.789 . . . . 0.0 111.599 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 70.36 2.57 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 173.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -72.92 67.63 0.85 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.725 2.01 . . . . 0.0 108.488 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -158.52 -163.79 1.34 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.044 0.938 . . . . 0.0 110.388 -169.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m -27.82 -42.13 0.02 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 127.827 2.451 . . . . 0.0 115.081 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.54 155.66 18.09 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -135.89 44.79 2.45 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.578 2.351 . . . . 0.0 107.182 169.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.4 p30 165.51 -49.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.107 2.163 . . . . 0.0 110.039 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 39.8 t0 74.45 59.39 0.08 Allowed 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 126.598 1.959 . . . . 0.0 111.271 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -80.67 5.75 14.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 111.43 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.29 34.32 15.97 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.734 1.613 . . . . 0.0 111.808 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.63 0.252 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 74.54 -40.64 0.45 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.721 2.008 . . . . 0.0 113.094 172.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -96.4 26.93 4.04 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.166 0.986 . . . . 0.0 111.102 -174.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -39.45 -49.52 2.07 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.561 1.545 . . . . 0.0 112.855 -169.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -45.69 -58.62 3.31 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.012 1.325 . . . . 0.0 111.143 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt -79.51 -48.77 20.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -113.87 86.09 2.34 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -78.22 -41.66 33.69 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.551 0.741 . . . . 0.0 109.632 171.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -175.56 -124.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 104.249 -2.501 . . . . 0.0 104.249 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -65.52 -38.98 91.26 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 168.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.874 -1.536 . . . . 0.0 109.697 169.65 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.224 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.7 p -71.08 -72.92 0.19 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 73.12 -172.11 50.19 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -173.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.94 71.46 1.55 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.161 0.584 . . . . 0.0 111.213 -176.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -75.93 55.82 0.93 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.651 0.781 . . . . 0.0 111.046 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 -68.39 0.18 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.834 2.454 . . . . 0.0 104.834 172.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.03 -48.53 22.09 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.335 1.054 . . . . 0.0 110.74 169.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -58.65 140.21 54.87 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -121.32 51.61 1.28 Allowed 'General case' 0 C--N 1.34 0.16 0 CA-C-O 121.924 0.868 . . . . 0.0 110.688 175.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.5 p30 175.62 -109.99 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.292 1.837 . . . . 0.0 106.161 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -172.64 27.05 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.543 1.537 . . . . 0.0 110.819 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -70.44 -18.99 63.0 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.836 -0.54 . . . . 0.0 111.209 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER 53.0 39.79 30.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.992 1.717 . . . . 0.0 112.644 -170.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.472 0.673 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -79.69 64.53 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? 96.54 103.63 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.297 2.639 . . . . 0.0 109.977 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.99 -30.36 14.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.749 1.22 . . . . 0.0 113.133 -178.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.2 tp -41.74 -43.26 2.84 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.818 1.247 . . . . 0.0 111.339 170.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.81 -57.57 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -58.28 -22.62 53.35 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -35.88 78.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.392 1.077 . . . . 0.0 111.222 173.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.26 59.89 4.14 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.826 0.85 . . . . 0.0 109.612 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -66.86 -36.01 81.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.176 0.59 . . . . 0.0 111.036 -176.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 23.7 pttm . . . . . 0 C--O 1.253 1.273 0 CA-C-O 116.869 -1.538 . . . . 0.0 109.089 178.549 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.191 0 N-CA-C 111.708 -0.557 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.0 m -75.38 49.7 0.48 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.861 1.264 . . . . 0.0 113.31 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.67 153.09 41.21 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -74.2 70.13 1.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.979 0.89 . . . . 0.0 111.683 -175.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -71.08 77.75 0.68 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -32.58 -44.28 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 127.878 2.471 . . . . 0.0 115.116 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p -44.3 -47.55 9.51 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.928 0.891 . . . . 0.0 111.182 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -79.54 103.67 9.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -81.05 -18.67 45.9 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 111.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -93.41 -28.01 16.39 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.218 0.463 . . . . 0.0 111.864 -171.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 74.67 35.37 0.67 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.488 2.315 . . . . 0.0 113.412 174.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -89.67 -5.71 56.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.591 0.757 . . . . 0.0 111.678 169.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 67.08 37.47 3.77 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.527 1.131 . . . . 0.0 110.601 -176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . 0.406 HD23 ' CZ ' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 121.269 0.557 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -79.13 62.49 3.54 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.714 0.805 . . . . 0.0 110.265 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -172.06 -44.6 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.511 1.524 . . . . 0.0 109.703 169.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -43.21 -51.24 6.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.443 1.497 . . . . 0.0 112.203 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.68 -38.84 70.17 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt -79.36 -46.32 23.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . 0.406 ' CZ ' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 -56.32 -25.96 50.61 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 -31.75 72.05 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.051 0.842 . . . . 0.0 111.491 173.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.32 65.54 2.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.63 0.772 . . . . 0.0 110.081 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -75.83 64.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.168 0.987 . . . . 0.0 111.028 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.339 -1.315 . . . . 0.0 110.252 171.172 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.9 m -73.4 40.35 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.993 1.317 . . . . 0.0 114.294 -171.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.23 -48.49 79.0 Favored Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -48.2 77.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.1 0.56 . . . . 0.0 110.131 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -57.84 -53.76 54.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.816 0.446 . . . . 0.0 109.847 176.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.79 -51.55 55.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.903 0.32 . . . . 0.0 110.316 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -52.53 -50.51 62.72 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.423 0.289 . . . . 0.0 110.838 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -68.7 106.19 2.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -91.63 -4.75 54.88 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -93.28 -26.74 17.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.725 0.693 . . . . 0.0 111.115 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 24.7 t0 65.94 36.84 5.72 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.657 2.383 . . . . 0.0 113.829 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -109.96 6.07 22.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.941 0.896 . . . . 0.0 112.622 172.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 85.65 -5.1 0.85 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 127.425 2.29 . . . . 0.0 113.824 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -53.69 -48.51 69.46 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.574 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -50.92 -55.58 16.47 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -56.85 -49.47 75.37 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.421 0.555 . . . . 0.0 110.271 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.5 tp -49.59 -46.89 49.64 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.444 0.698 . . . . 0.0 111.38 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp -78.92 -60.52 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 118.684 0.675 . . . . 0.0 110.407 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 16.4 m-30 -57.59 -34.36 69.16 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -68.09 -59.1 3.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.895 0.771 . . . . 0.0 111.058 171.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -61.67 -26.69 68.18 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -170.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -58.34 -30.24 66.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.843 0.457 . . . . 0.0 111.351 174.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.876 -1.535 . . . . 0.0 110.579 175.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.251 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.6 p -76.16 66.7 2.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.634 0.773 . . . . 0.0 110.046 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -77.68 -161.26 15.17 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 109.926 -1.269 . . . . 0.0 109.926 170.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.7 mp0 -74.86 60.56 0.96 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.134 0.974 . . . . 0.0 109.922 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 23.7 mtp-105 -75.33 73.9 2.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.866 0.867 . . . . 0.0 109.738 -176.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -39.17 -47.38 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.152 1.381 . . . . 0.0 111.734 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m 71.12 -56.43 0.63 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.862 1.665 . . . . 0.0 112.2 178.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -81.28 102.18 10.23 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -67.72 -27.59 66.93 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.951 -0.468 . . . . 0.0 109.799 169.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 31.9 p30 -75.26 -14.92 60.55 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.605 0.762 . . . . 0.0 112.452 175.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.1 t0 29.62 51.23 0.08 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.803 2.041 . . . . 0.0 114.525 -169.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -117.54 15.22 14.63 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.94 0.896 . . . . 0.0 111.942 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 79.63 -15.7 0.73 Allowed 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.495 1.918 . . . . 0.0 114.382 -177.561 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.13 79.04 1.75 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.657 0.783 . . . . 0.0 109.462 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.53 62.82 0.77 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.662 0.785 . . . . 0.0 111.63 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -54.07 -33.23 56.94 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.5 -0.75 . . . . 0.0 112.122 -176.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -56.94 -20.7 24.99 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp -55.04 -19.85 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.715 -0.616 . . . . 0.0 111.131 171.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -83.83 77.22 9.93 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -74.49 61.33 0.93 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.987 1.315 . . . . 0.0 110.664 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -162.89 158.09 22.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.995 1.718 . . . . 0.0 106.635 -174.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 66.79 -65.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.482 1.513 . . . . 0.0 111.767 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 C--O 1.249 1.068 0 CA-C-O 116.849 -1.548 . . . . 0.0 108.554 177.601 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.951 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 21.8 p -76.05 64.5 1.94 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.926 0.891 . . . . 0.0 108.614 174.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 70.35 -69.58 0.68 Allowed Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -169.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.02 154.77 36.79 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtp85 -69.59 72.16 0.34 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.278 0.631 . . . . 0.0 112.019 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -75.01 70.85 2.05 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m -43.94 -38.35 3.38 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.366 1.066 . . . . 0.0 112.587 -173.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -70.15 135.26 48.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.09 15.67 4.19 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.599 174.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -113.2 -31.86 6.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.718 1.207 . . . . 0.0 111.166 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 21.9 t0 84.39 13.95 0.27 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.56 2.344 . . . . 0.0 114.14 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -66.83 -15.84 63.87 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 120.901 -1.124 . . . . 0.0 110.128 169.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 67.28 42.01 2.36 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.267 1.827 . . . . 0.0 110.633 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.848 0.356 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 85.2 tttt 41.12 -98.59 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.663 1.985 . . . . 0.0 112.051 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -38.9 -52.48 1.76 Allowed 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.006 1.322 . . . . 0.0 110.566 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -46.61 -50.45 17.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.6 1.16 . . . . 0.0 110.776 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.24 -38.39 83.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.92 0.488 . . . . 0.0 110.348 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.79 -53.34 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -174.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 14.4 m-85 -67.54 -22.25 65.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -76.88 -16.69 59.33 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.421 1.488 . . . . 0.0 111.293 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -51.25 124.8 12.5 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 118.888 0.767 . . . . 0.0 111.83 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -75.99 64.64 1.92 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.643 0.777 . . . . 0.0 109.247 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 22.7 tptm . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.04 -1.457 . . . . 0.0 110.965 -175.022 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.309 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.1 p -72.74 75.88 1.12 Allowed 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.098 -0.648 . . . . 0.0 109.477 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -48.64 -47.76 29.67 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -91.52 95.71 10.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.52 130.52 44.01 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.91 150.53 45.64 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m -40.52 -48.0 2.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.038 1.335 . . . . 0.0 113.095 176.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -77.89 103.91 8.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.3 ptt85 -84.56 -18.38 35.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.238 0.615 . . . . 0.0 111.501 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -83.44 -14.26 52.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.424 0.556 . . . . 0.0 111.977 -178.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 p30 60.21 16.77 6.35 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.081 2.553 . . . . 0.0 115.977 174.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.9 6.15 49.56 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.282 0.946 . . . . 0.0 112.334 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER 83.86 -8.94 1.01 Allowed 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 128.151 2.58 . . . . 0.0 113.708 -177.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.5 tptm . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.63 -171.74 2.79 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.869 1.268 . . . . 0.0 108.61 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 67.62 -68.55 0.16 Allowed 'General case' 0 C--O 1.227 -0.096 0 C-N-CA 125.698 1.599 . . . . 0.0 110.695 -169.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -64.17 -29.06 70.19 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.108 0.963 . . . . 0.0 111.195 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.8 mp -75.44 75.33 2.51 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm -48.06 -39.99 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 125.298 1.439 . . . . 0.0 111.722 -169.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -74.0 34.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -75.23 -30.76 60.64 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 121.131 -0.98 . . . . 0.0 110.608 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.9 t70 69.08 -58.02 0.51 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 127.254 2.222 . . . . 0.0 111.609 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -68.47 75.56 0.26 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.751 1.62 . . . . 0.0 109.325 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt . . . . . 0 C--O 1.25 1.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.127 176.058 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 111.546 -0.622 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.7 m -64.77 -31.61 72.92 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.831 0.452 . . . . 0.0 111.737 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.64 -69.16 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.53 148.51 37.64 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.438 0.695 . . . . 0.0 110.858 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -76.73 41.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.131 0.972 . . . . 0.0 112.817 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -102.09 -63.5 1.15 Allowed 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 102.504 -3.147 . . . . 0.0 102.504 168.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m 44.74 36.02 1.66 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.387 1.475 . . . . 0.0 112.205 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -64.17 101.48 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -72.25 -10.3 59.6 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.8 -0.563 . . . . 0.0 112.179 -173.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -108.73 -7.25 15.62 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.854 0.862 . . . . 0.0 112.701 172.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.4 t0 42.57 41.8 2.51 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.402 1.881 . . . . 0.0 114.841 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -73.56 -31.06 63.43 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.042 -1.036 . . . . 0.0 110.829 170.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.28 30.4 m-80 109.85 26.41 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 130.269 3.428 . . . . 0.0 111.759 -176.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 111.208 0.077 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -52.32 123.44 10.81 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 70.44 -58.72 0.54 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.661 1.585 . . . . 0.0 111.005 -173.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -42.52 -49.82 5.33 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.831 1.652 . . . . 0.0 112.484 -177.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.5 tt -51.21 -42.94 61.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.28 1.032 . . . . 0.0 111.297 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt -82.25 -45.37 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.7 m-85 -85.3 38.22 0.72 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -70.42 -47.8 59.03 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.201 -170.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 43.1 t0 65.56 166.27 0.18 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.07 1.348 . . . . 0.0 111.114 -172.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -75.11 69.63 2.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.277 1.031 . . . . 0.0 109.577 -179.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 59.7 mttp . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.292 -1.337 . . . . 0.0 110.405 172.985 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 111.156 -0.777 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.8 m -65.38 67.32 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.277 1.831 . . . . 0.0 113.529 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 37.02 -121.86 0.8 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.826 2.155 . . . . 0.0 113.177 172.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -57.46 -43.61 84.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.443 0.697 . . . . 0.0 111.106 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -41.67 96.52 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.04 -48.66 67.63 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 122.169 -0.332 . . . . 0.0 110.181 173.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -49.58 -43.51 46.28 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 122.757 0.423 . . . . 0.0 110.609 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -55.67 120.07 6.7 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.4 ptt-85 -79.37 -25.49 42.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -120.5 0.48 10.51 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -169.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.7 t0 59.9 27.42 16.77 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.854 1.261 . . . . 0.0 112.797 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -69.92 -9.78 56.2 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.7 -1.25 . . . . 0.0 111.242 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 70.68 34.05 2.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.949 2.1 . . . . 0.0 111.522 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.24 -37.46 47.18 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.886 0.475 . . . . 0.0 111.528 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -55.44 -20.13 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -53.1 -38.22 62.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.694 1.588 . . . . 0.0 111.189 170.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.15 -11.09 27.05 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.454 0.701 . . . . 0.0 112.352 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm -107.61 -54.31 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.92 1.288 . . . . 0.0 108.531 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 10.8 m-30 -66.75 -28.27 68.28 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.48 -45.97 61.08 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.674 0.79 . . . . 0.0 110.36 170.168 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.29 64.75 0.81 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.71 0.804 . . . . 0.0 111.519 -176.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -73.47 71.17 1.3 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.052 0.941 . . . . 0.0 110.005 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.092 -1.432 . . . . 0.0 110.821 174.493 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.297 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.9 p -12.02 -76.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 128.394 2.678 . . . . 0.0 113.968 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -126.64 29.47 4.46 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.267 1.413 . . . . 0.0 110.881 173.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -81.24 58.12 3.44 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.68 0.792 . . . . 0.0 110.025 -172.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 70.6 mmt-85 -78.37 49.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.628 0.771 . . . . 0.0 111.309 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -71.6 149.96 45.14 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -39.44 -47.84 1.88 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.313 1.445 . . . . 0.0 112.387 175.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -58.2 103.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -65.85 -16.91 64.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -169.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 37.1 p30 -114.14 0.63 14.32 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.524 0.602 . . . . 0.0 112.461 177.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.1 t0 44.74 44.74 7.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.584 1.154 . . . . 0.0 113.299 -175.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -77.67 -17.69 57.43 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.483 -0.761 . . . . 0.0 111.714 174.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 103.1 17.8 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.489 3.115 . . . . 0.0 112.271 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -74.52 76.48 1.96 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -36.0 -46.18 0.47 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.956 2.102 . . . . 0.0 111.919 -178.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -32.34 -52.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.135 2.174 . . . . 0.0 112.549 173.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.71 -39.23 76.75 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.02 0.528 . . . . 0.0 111.423 -176.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt -81.14 -46.01 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -178.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 15.4 m-30 -65.13 -17.18 64.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -48.44 -29.36 3.99 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.96 0.8 . . . . 0.0 110.914 169.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.5 -21.94 18.91 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -56.14 132.96 51.76 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.016 0.825 . . . . 0.0 111.358 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.25 -1.357 . . . . 0.0 109.332 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.291 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.1 t 59.91 -152.73 0.39 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.669 0.788 . . . . 0.0 110.156 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.95 -65.76 2.21 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -75.04 61.92 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.247 1.019 . . . . 0.0 109.707 176.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -76.22 67.48 2.49 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.794 0.837 . . . . 0.0 108.887 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -78.19 58.69 2.1 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.546 -0.721 . . . . 0.0 109.657 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m -47.27 -38.45 12.47 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.638 1.175 . . . . 0.0 110.896 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -76.92 104.93 7.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -86.23 -7.13 58.76 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.043 -0.503 . . . . 0.0 112.351 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -102.97 -28.47 12.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.235 0.614 . . . . 0.0 112.212 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.5 t0 75.55 38.18 0.4 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.571 2.348 . . . . 0.0 113.65 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -95.96 -0.78 50.26 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.668 0.787 . . . . 0.0 112.345 169.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 79.3 12.8 1.21 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.835 2.054 . . . . 0.0 113.382 -176.87 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 120.174 0.035 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -70.75 79.06 0.61 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.941 0.896 . . . . 0.0 109.273 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -55.29 -20.76 12.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.569 1.147 . . . . 0.0 113.341 -174.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 47.5 mp0 -45.98 -43.3 14.05 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.079 0.951 . . . . 0.0 110.414 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 89.5 mt -56.98 -36.5 70.41 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.889 0.476 . . . . 0.0 111.119 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt -73.56 -53.56 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 9.0 m-30 -74.25 46.12 0.24 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -164.57 88.41 0.49 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.044 0.938 . . . . 0.0 109.091 -170.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.76 146.24 17.54 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 169.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -76.04 63.2 1.75 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.558 0.743 . . . . 0.0 110.546 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.295 -1.336 . . . . 0.0 110.283 175.377 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.023 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.8 m -75.15 73.96 2.29 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.2 0.6 . . . . 0.0 110.996 -177.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 58.19 -112.38 3.87 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.319 1.437 . . . . 0.0 111.274 172.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -53.36 -36.55 61.5 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.344 0.658 . . . . 0.0 110.46 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -78.08 72.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -53.05 155.86 2.35 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.354 1.062 . . . . 0.0 110.477 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p -44.87 -49.22 11.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.051 0.941 . . . . 0.0 110.999 176.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -71.89 102.41 2.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -62.76 -19.41 63.95 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -175.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -111.18 0.38 16.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.085 0.857 . . . . 0.0 112.48 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.9 t70 44.61 35.58 1.45 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.303 1.441 . . . . 0.0 114.44 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -69.49 -5.89 27.04 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.655 -1.278 . . . . 0.0 111.365 170.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 77.03 28.95 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.635 2.374 . . . . 0.0 111.44 177.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 120.427 0.156 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -55.51 120.11 6.68 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -77.93 68.97 4.09 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -41.1 -48.27 3.31 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 126.254 1.821 . . . . 0.0 112.11 -172.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 85.9 mt -45.89 -46.72 16.06 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.76 0.824 . . . . 0.0 112.1 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt -88.13 -49.22 14.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 12.0 m-30 -64.58 -34.81 79.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.32 -44.97 93.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.565 0.621 . . . . 0.0 110.629 169.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -57.3 -47.82 80.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.565 0.62 . . . . 0.0 110.747 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.34 -47.16 85.44 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.954 0.901 . . . . 0.0 110.147 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 51.4 tttm . . . . . 0 C--O 1.252 1.193 0 CA-C-O 116.649 -1.643 . . . . 0.0 110.115 -176.802 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.1 m -74.71 66.73 1.5 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.78 0.832 . . . . 0.0 110.372 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 67.78 20.18 72.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.443 0.545 . . . . 0.0 111.954 -171.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.88 64.8 8.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.773 1.229 . . . . 0.0 109.984 -174.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.4 mmp_? 48.96 35.22 6.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.651 1.58 . . . . 0.0 113.404 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -70.48 148.37 48.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 171.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.15 -51.79 0.18 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.501 1.92 . . . . 0.0 112.252 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -75.75 116.72 16.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -109.09 -3.26 17.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.135 0.974 . . . . 0.0 111.976 172.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -100.03 -28.36 13.1 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.477 0.711 . . . . 0.0 111.52 -175.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 82.89 29.09 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.442 2.297 . . . . 0.0 113.016 170.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -83.65 -11.66 56.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.799 0.84 . . . . 0.0 112.078 169.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.62 33.71 4.89 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.284 1.433 . . . . 0.0 111.335 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 121.22 0.533 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -53.03 -35.73 59.76 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.291 1.036 . . . . 0.0 112.016 -175.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 27.4 mtm105 -58.99 -38.71 79.81 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.647 0.379 . . . . 0.0 111.648 176.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -85.51 -39.37 17.53 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.631 0.773 . . . . 0.0 109.986 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.87 73.05 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm -41.65 -44.94 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 126.359 1.864 . . . . 0.0 112.979 -169.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 8.2 m-30 -67.37 -37.72 83.63 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 19.58 73.28 0.02 OUTLIER 'General case' 0 C--N 1.342 0.278 0 C-N-CA 128.391 2.677 . . . . 0.0 114.091 -175.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -47.02 -33.09 4.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.754 0.822 . . . . 0.0 112.818 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -68.83 80.2 0.3 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.335 0.654 . . . . 0.0 110.046 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.929 1.692 . . . . 0.0 108.304 169.747 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.522 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.523 ' HB ' HD12 ' A' ' 168' ' ' LEU . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.557 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.413 ' N ' HD11 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.5 m-30 . . . . . 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 121.162 0.506 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.474 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 . . . . . 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.524 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 168' ' ' LEU . 1.7 m-30 . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.485 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 . . . . . 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.431 HG23 ' HG2' ' B' ' 245' ' ' GLU . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.702 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 245' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' A' ' 166' ' ' THR . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 168' ' ' LEU . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.702 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.5 m-30 . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.069 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.7 m-30 . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 . . . . . 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 121.002 0.429 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.489 ' HB ' HD12 ' A' ' 168' ' ' LEU . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.545 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.545 ' CE1' HD23 ' A' ' 168' ' ' LEU . 7.1 m-30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 121.622 0.725 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.423 ' CE ' HD13 ' A' ' 168' ' ' LEU . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.798 ' HB ' HD12 ' A' ' 168' ' ' LEU . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.798 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.43 ' HB2' ' CE2' ' B' ' 253' ' ' PHE 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.57 HD13 HD22 ' A' ' 168' ' ' LEU . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.43 ' CE2' ' HB2' ' B' ' 249' ' ' HIS . 10.7 m-30 . . . . . 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' PHE . . . . . 0.469 ' CE2' HD21 ' B' ' 252' ' ' LEU . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.505 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.409 HG22 ' CE1' ' B' ' 249' ' ' HIS . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.707 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.409 ' CE1' HG22 ' A' ' 166' ' ' THR . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 168' ' ' LEU . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.707 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.5 m-30 . . . . . 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.163 0.506 . . . . 0.0 111.808 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.703 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.2 p90 . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.56 ' CE ' HD13 ' A' ' 168' ' ' LEU . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.664 ' HB ' HD12 ' A' ' 168' ' ' LEU . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.664 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 119.953 -0.07 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' PHE . . . . . 0.423 ' CD2' HD11 ' A' ' 118' ' ' ILE . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ILE . . . . . 0.423 HD11 ' CD2' ' A' ' 107' ' ' PHE . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.457 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.369 0.604 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.514 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.867 HD23 ' CE1' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt . . . . . 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.58 ' HA ' HD21 ' A' ' 168' ' ' LEU . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.867 ' CE1' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.421 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 . . . . . 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.407 ' HE3' HD13 ' A' ' 168' ' ' LEU . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.684 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-O 121.148 0.499 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.448 HD13 HD22 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.684 ' CE1' HD23 ' A' ' 168' ' ' LEU . 16.4 m-30 . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.532 0.285 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ALA . . . . . 0.401 ' HB3' HD13 ' A' ' 154' ' ' ILE . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.037 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.401 HD13 ' HB3' ' A' ' 146' ' ' ALA . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.409 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 119.824 -0.132 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' PHE . . . . . 0.43 ' CZ ' HD12 ' B' ' 251' ' ' LEU . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 122.172 0.987 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.464 ' CG2' HD12 ' A' ' 168' ' ' LEU . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.682 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 251' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 110' ' ' PHE . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.404 HD22 ' CZ ' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.682 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.4 m-85 . . . . . 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' A' ' 154' ' ' ILE . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ALA . . . . . 0.562 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 . . . . . 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 143' ' ' ILE . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.69 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 168' ' ' LEU . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.69 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.0 m-30 . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.411 HG21 ' HA ' ' A' ' 152' ' ' ASN . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 . . . . . 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ASN . . . . . 0.411 ' HA ' HG21 ' A' ' 143' ' ' ILE 0.28 30.4 m-80 . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.478 ' HB ' HD12 ' A' ' 168' ' ' LEU . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.513 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.513 ' CE1' HD23 ' A' ' 168' ' ' LEU . 6.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ILE . . . . . 0.67 ' HA ' HD11 ' A' ' 154' ' ' ILE . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 . . . . . 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.483 0.659 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' ILE . . . . . 0.67 HD11 ' HA ' ' A' ' 143' ' ' ILE . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 168' ' ' LEU . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.565 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 246' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' B' ' 249' ' ' HIS . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.481 ' HA ' HD21 ' A' ' 168' ' ' LEU 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.565 ' CE1' HD23 ' A' ' 168' ' ' LEU . 10.8 m-30 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.41 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.521 ' CE ' HD13 ' A' ' 168' ' ' LEU . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.658 ' HB ' HD12 ' A' ' 168' ' ' LEU . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.696 ' CE1' HD23 ' A' ' 168' ' ' LEU . 15.4 m-30 . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 119.704 -0.189 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.426 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.673 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 252' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 168' ' ' LEU . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.673 ' CE1' HD23 ' A' ' 168' ' ' LEU . 9.0 m-30 . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 . . . . . 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.572 0.225 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' THR . . . . . 0.442 ' CG2' HD12 ' A' ' 168' ' ' LEU . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.622 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 249' ' ' HIS . . . . . 0.426 ' CE1' HG22 ' A' ' 166' ' ' THR . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.622 ' CE1' HD23 ' A' ' 168' ' ' LEU . 12.0 m-30 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLU . . . . . 0.522 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.535 0.394 0 CA-C-O 120.955 0.407 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' MET . . . . . 0.476 ' CE ' HD13 ' A' ' 168' ' ' LEU . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' LEU . . . . . 0.646 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 253' ' ' PHE . . . . . 0.646 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.2 m-30 . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 11.4 p -70.19 -61.47 1.76 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.818 0.847 . . . . 0.0 109.401 177.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 56.57 -101.97 0.17 Allowed Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.159 1.361 . . . . 0.0 110.507 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -62.58 -52.04 64.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.43 66.23 7.93 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.808 0.843 . . . . 0.0 108.948 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -124.43 155.57 38.63 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 124.172 0.989 . . . . 0.0 111.312 -173.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.07 -30.21 1.04 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 127.255 2.222 . . . . 0.0 113.178 174.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -72.84 121.62 20.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -124.7 16.1 8.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.484 1.514 . . . . 0.0 110.796 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 46.3 p30 -111.1 -15.9 13.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.341 1.456 . . . . 0.0 111.926 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 61.53 29.78 18.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.399 1.88 . . . . 0.0 112.59 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.55 -6.86 15.25 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.59 0.756 . . . . 0.0 112.761 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER 77.92 12.16 1.88 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.733 1.613 . . . . 0.0 113.759 177.539 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.522 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.523 ' HB ' HD12 ' A' ' 168' ' ' LEU . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.557 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -48.21 -47.99 35.24 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.08 0.552 . . . . 0.0 111.704 -174.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -44.63 -54.84 5.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.746 0.819 . . . . 0.0 111.211 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.85 -50.74 71.05 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.361 0.665 . . . . 0.0 109.579 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.36 -37.31 72.41 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.36 0.264 . . . . 0.0 111.53 -177.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt -74.39 -51.02 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.932 0.893 . . . . 0.0 109.727 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.413 ' N ' HD11 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.5 m-30 -77.66 37.82 0.24 Allowed 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -83.75 60.88 6.01 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 120.658 -1.276 . . . . 0.0 108.68 -178.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.89 79.1 0.21 Allowed 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.855 1.262 . . . . 0.0 110.386 -171.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.49 -70.63 0.1 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.905 2.082 . . . . 0.0 108.472 -171.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.386 173.009 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 4.0 p -69.94 -68.91 0.38 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.986 0.914 . . . . 0.0 109.156 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 42.83 -129.07 5.23 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 125.501 1.524 . . . . 0.0 111.896 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -67.82 -16.22 64.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.107 0.963 . . . . 0.0 112.694 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -88.16 -69.26 0.71 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -177.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.4 t70 43.92 -137.11 0.41 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.086 0.955 . . . . 0.0 110.162 -169.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p -80.35 56.04 2.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.335 1.454 . . . . 0.0 109.73 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.474 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ASP . . . . . 0.442 ' HB3' ' H ' ' A' ' 150' ' ' ASP . 68.2 m-20 -75.02 128.67 36.11 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -83.68 55.29 3.17 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 172.13 -57.33 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.111 1.765 . . . . 0.0 110.842 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.442 ' H ' ' HB3' ' A' ' 147' ' ' ASP . 50.6 t0 79.6 57.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 127.385 2.274 . . . . 0.0 110.324 -171.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.65 14.82 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.366 1.066 . . . . 0.0 111.334 170.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER 75.57 -8.69 1.55 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 126.478 1.911 . . . . 0.0 114.713 -173.29 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.524 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.578 0.228 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.61 71.39 1.38 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.444 0.698 . . . . 0.0 109.965 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.8 mtm105 -42.41 -40.24 2.48 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.256 1.422 . . . . 0.0 111.805 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -29.56 -52.28 0.12 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.642 1.977 . . . . 0.0 112.431 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 64.5 tp -55.37 -46.24 76.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.24 0.616 . . . . 0.0 111.043 -177.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt -76.78 -47.89 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 168' ' ' LEU . 1.7 m-30 -74.08 51.88 0.43 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -79.99 65.27 5.1 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 120.457 -1.402 . . . . 0.0 108.857 174.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -67.17 -36.41 81.74 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 171.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.22 53.89 0.84 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.138 0.975 . . . . 0.0 110.24 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.406 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.074 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.9 m -74.31 72.08 1.77 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 76.48 -57.88 3.34 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.19 161.62 8.57 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.54 0.736 . . . . 0.0 110.197 171.25 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.61 148.98 14.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.971 1.308 . . . . 0.0 110.509 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -50.83 -34.04 26.14 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.019 0.928 . . . . 0.0 113.115 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -43.27 -41.61 4.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.816 1.247 . . . . 0.0 112.263 172.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.485 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 16.9 mm100 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -68.06 132.2 46.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -116.01 -6.25 11.97 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.909 0.884 . . . . 0.0 112.163 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -111.99 -9.22 14.02 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.076 0.95 . . . . 0.0 112.934 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 27.9 t0 64.46 35.22 9.63 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.998 2.119 . . . . 0.0 112.98 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -88.88 -11.39 44.74 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.9 t30 70.04 25.95 4.67 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.326 1.851 . . . . 0.0 112.462 -176.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.431 HG23 ' HG2' ' B' ' 245' ' ' GLU . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.702 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -108.05 103.22 12.39 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.208 1.003 . . . . 0.0 108.36 175.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 63.77 6.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.718 0.807 . . . . 0.0 109.939 -170.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -30.04 -58.96 0.18 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.985 2.114 . . . . 0.0 113.926 -169.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 65.1 tp -51.08 -47.88 61.77 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.736 0.814 . . . . 0.0 112.07 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp -79.71 -45.84 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -177.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 245' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' A' ' 166' ' ' THR . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 168' ' ' LEU . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.702 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.5 m-30 -71.43 62.95 0.37 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -170.11 -47.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.813 1.645 . . . . 0.0 108.452 -169.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.5 t70 46.29 -139.52 0.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.2 1.4 . . . . 0.0 111.389 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 69.09 -62.72 0.39 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.189 1.796 . . . . 0.0 110.944 -173.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.596 169.971 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.298 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.4 m -49.87 -40.62 43.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.632 1.173 . . . . 0.0 112.513 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -73.26 65.76 1.6 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -63.24 -49.26 74.85 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.784 0.834 . . . . 0.0 110.63 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.47 -68.92 0.37 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 t70 36.95 -135.48 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.078 2.151 . . . . 0.0 112.059 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p -73.47 -41.16 63.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.776 1.631 . . . . 0.0 109.449 172.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -78.65 105.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -73.69 -20.82 60.43 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.365 -0.35 . . . . 0.0 111.809 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -95.16 -33.3 12.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.998 0.519 . . . . 0.0 111.67 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 28.0 t0 74.59 42.72 0.28 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.269 2.628 . . . . 0.0 113.777 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -100.65 9.98 41.77 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.316 1.046 . . . . 0.0 112.174 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 76.44 -3.71 2.49 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 126.539 1.935 . . . . 0.0 113.945 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.2 pttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -76.83 62.85 2.12 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.257 1.023 . . . . 0.0 109.788 -175.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.68 64.5 6.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.084 0.954 . . . . 0.0 110.852 -173.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -103.56 -89.17 0.4 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 169.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 81.2 mt -125.08 174.6 7.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.65 -45.63 84.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.7 m-30 -75.66 36.14 0.13 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -73.44 -4.1 31.59 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.099 -1.0 . . . . 0.0 111.764 -171.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -44.33 -36.36 2.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 125.748 1.619 . . . . 0.0 110.359 169.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -69.17 72.8 0.29 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.856 0.462 . . . . 0.0 110.138 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.26 1.824 . . . . 0.0 111.04 174.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -71.28 65.5 0.41 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.089 1.356 . . . . 0.0 110.61 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -29.01 -66.62 0.09 OUTLIER Glycine 0 CA--C 1.529 0.932 0 C-N-CA 126.873 2.177 . . . . 0.0 114.811 -169.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -59.32 -50.88 72.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.402 0.681 . . . . 0.0 110.788 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -57.59 -50.9 71.59 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.364 0.666 . . . . 0.0 109.419 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.79 -48.48 81.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.201 0.601 . . . . 0.0 109.632 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m -54.86 -50.96 67.39 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.402 0.281 . . . . 0.0 110.37 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -77.28 105.56 8.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -80.47 -17.02 52.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.223 -0.418 . . . . 0.0 112.12 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -96.51 -28.9 14.19 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.431 0.56 . . . . 0.0 112.306 -172.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 t0 76.02 38.01 0.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.414 2.286 . . . . 0.0 113.562 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -94.71 -2.09 51.79 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.998 0.919 . . . . 0.0 112.522 169.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 71.21 32.82 2.13 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.894 1.278 . . . . 0.0 110.837 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.489 ' HB ' HD12 ' A' ' 168' ' ' LEU . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.545 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.541 0.21 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.35 70.22 10.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 175.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.3 -45.43 4.21 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.109 0.964 . . . . 0.0 111.298 -177.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -44.06 -50.0 8.58 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.917 1.287 . . . . 0.0 111.388 178.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 75.3 mt -69.97 -23.88 63.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.971 0.508 . . . . 0.0 111.588 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm -81.66 -49.09 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.545 ' CE1' HD23 ' A' ' 168' ' ' LEU . 7.1 m-30 -60.21 -26.58 66.5 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -29.04 3.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.0 0.92 . . . . 0.0 112.436 172.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -58.89 -23.09 60.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 51.4 tttp 53.03 40.34 31.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.796 1.238 . . . . 0.0 111.072 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.346 -1.312 . . . . 0.0 110.026 176.071 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 12.4 p -72.62 171.32 12.69 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.995 0.518 . . . . 0.0 109.895 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.38 -62.67 4.45 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -109.04 166.38 10.88 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.623 1.169 . . . . 0.0 109.89 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.01 70.43 2.02 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -39.16 -54.99 1.71 Allowed 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.976 1.711 . . . . 0.0 112.197 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -50.85 -48.4 60.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.672 0.789 . . . . 0.0 111.728 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -74.26 104.19 4.94 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -91.58 -11.69 36.49 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.86 0.464 . . . . 0.0 111.553 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -95.82 -20.58 18.71 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.918 0.487 . . . . 0.0 112.274 -169.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 75.91 33.14 0.62 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.611 1.964 . . . . 0.0 112.902 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 -84.54 -13.73 50.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.762 0.825 . . . . 0.0 111.788 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 65.29 39.0 5.55 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.913 1.285 . . . . 0.0 110.183 -171.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.423 ' CE ' HD13 ' A' ' 168' ' ' LEU . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.798 ' HB ' HD12 ' A' ' 168' ' ' LEU . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.798 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -45.41 -40.66 8.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.726 1.21 . . . . 0.0 112.457 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.4 mtp-105 -45.87 -41.91 11.89 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.33 -46.73 87.79 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.369 0.531 . . . . 0.0 110.059 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.02 -44.79 94.97 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.033 0.533 . . . . 0.0 109.625 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.56 -61.03 1.72 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.43 ' HB2' ' CE2' ' B' ' 253' ' ' PHE 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.57 HD13 HD22 ' A' ' 168' ' ' LEU . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.43 ' CE2' ' HB2' ' B' ' 249' ' ' HIS . 10.7 m-30 -60.9 -30.5 70.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -58.68 -29.75 66.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.547 0.612 . . . . 0.0 111.582 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -75.15 67.23 1.78 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.327 0.967 . . . . 0.0 110.05 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -73.62 73.44 1.48 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.13 0.972 . . . . 0.0 109.856 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 93.0 mttt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.207 -1.378 . . . . 0.0 110.946 175.278 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.4 m 69.91 -60.43 0.48 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.76 1.624 . . . . 0.0 110.398 -173.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.02 67.29 1.75 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -67.54 93.94 0.38 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.191 0.596 . . . . 0.0 109.604 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -72.29 61.19 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.128 0.971 . . . . 0.0 111.574 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -115.14 -75.52 0.59 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.204 1.402 . . . . 0.0 108.75 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m 51.37 26.07 2.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 112.841 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.469 ' CE2' HD21 ' B' ' 252' ' ' LEU . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -84.83 112.9 20.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -11.62 23.49 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.134 0.974 . . . . 0.0 111.552 169.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -87.02 -15.17 39.46 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.26 1.024 . . . . 0.0 112.054 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.1 p30 59.26 15.13 4.04 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.824 2.45 . . . . 0.0 115.454 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -94.56 2.03 55.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.813 0.845 . . . . 0.0 112.042 175.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER 83.7 -15.35 0.62 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 127.647 2.379 . . . . 0.0 113.059 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.505 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.409 HG22 ' CE1' ' B' ' 249' ' ' HIS . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.707 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.5 mttm . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -75.39 69.52 2.19 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.73 -24.85 24.06 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.262 1.025 . . . . 0.0 112.746 -173.294 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -44.38 -41.76 6.39 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.23 1.012 . . . . 0.0 111.729 170.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.78 -34.2 71.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.677 0.391 . . . . 0.0 111.062 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt -75.5 -49.08 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.409 ' CE1' HG22 ' A' ' 166' ' ' THR . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 168' ' ' LEU . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.707 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.5 m-30 -71.8 -43.19 66.08 Favored 'General case' 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 33.44 -112.98 0.05 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.092 1.757 . . . . 0.0 113.615 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -70.3 -57.03 5.32 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.03 154.04 33.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 169.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.186 -1.388 . . . . 0.0 109.918 -179.767 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 m -72.89 58.88 0.48 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.297 1.439 . . . . 0.0 111.92 -176.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -81.03 57.61 4.84 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 123.956 0.789 . . . . 0.0 111.599 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 70.36 2.57 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 173.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -72.92 67.63 0.85 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.725 2.01 . . . . 0.0 108.488 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -158.52 -163.79 1.34 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.044 0.938 . . . . 0.0 110.388 -169.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m -27.82 -42.13 0.02 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 127.827 2.451 . . . . 0.0 115.081 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.54 155.66 18.09 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -135.89 44.79 2.45 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.578 2.351 . . . . 0.0 107.182 169.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.4 p30 165.51 -49.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.107 2.163 . . . . 0.0 110.039 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 39.8 t0 74.45 59.39 0.08 Allowed 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 126.598 1.959 . . . . 0.0 111.271 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -80.67 5.75 14.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 111.43 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.29 34.32 15.97 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.734 1.613 . . . . 0.0 111.808 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.63 0.252 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 74.54 -40.64 0.45 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.721 2.008 . . . . 0.0 113.094 172.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -96.4 26.93 4.04 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.166 0.986 . . . . 0.0 111.102 -174.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -39.45 -49.52 2.07 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.561 1.545 . . . . 0.0 112.855 -169.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -45.69 -58.62 3.31 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.012 1.325 . . . . 0.0 111.143 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt -79.51 -48.77 20.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.703 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.2 p90 -113.87 86.09 2.34 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -78.22 -41.66 33.69 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.551 0.741 . . . . 0.0 109.632 171.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -175.56 -124.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 104.249 -2.501 . . . . 0.0 104.249 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -65.52 -38.98 91.26 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 168.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.874 -1.536 . . . . 0.0 109.697 169.65 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.224 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.7 p -71.08 -72.92 0.19 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 73.12 -172.11 50.19 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -173.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.94 71.46 1.55 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.161 0.584 . . . . 0.0 111.213 -176.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -75.93 55.82 0.93 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.651 0.781 . . . . 0.0 111.046 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 -68.39 0.18 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.834 2.454 . . . . 0.0 104.834 172.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.03 -48.53 22.09 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.335 1.054 . . . . 0.0 110.74 169.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -58.65 140.21 54.87 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -121.32 51.61 1.28 Allowed 'General case' 0 C--N 1.34 0.16 0 CA-C-O 121.924 0.868 . . . . 0.0 110.688 175.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.5 p30 175.62 -109.99 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.292 1.837 . . . . 0.0 106.161 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -172.64 27.05 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.543 1.537 . . . . 0.0 110.819 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -70.44 -18.99 63.0 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.836 -0.54 . . . . 0.0 111.209 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER 53.0 39.79 30.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.992 1.717 . . . . 0.0 112.644 -170.476 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.56 ' CE ' HD13 ' A' ' 168' ' ' LEU . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.664 ' HB ' HD12 ' A' ' 168' ' ' LEU . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.664 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.472 0.673 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -79.69 64.53 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? 96.54 103.63 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.297 2.639 . . . . 0.0 109.977 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.99 -30.36 14.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.749 1.22 . . . . 0.0 113.133 -178.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.2 tp -41.74 -43.26 2.84 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.818 1.247 . . . . 0.0 111.339 170.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.81 -57.57 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -58.28 -22.62 53.35 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -35.88 78.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.392 1.077 . . . . 0.0 111.222 173.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.26 59.89 4.14 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.826 0.85 . . . . 0.0 109.612 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -66.86 -36.01 81.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.176 0.59 . . . . 0.0 111.036 -176.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 23.7 pttm . . . . . 0 C--O 1.253 1.273 0 CA-C-O 116.869 -1.538 . . . . 0.0 109.089 178.549 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.191 0 N-CA-C 111.708 -0.557 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.0 m -75.38 49.7 0.48 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.861 1.264 . . . . 0.0 113.31 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.67 153.09 41.21 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -74.2 70.13 1.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.979 0.89 . . . . 0.0 111.683 -175.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -71.08 77.75 0.68 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -32.58 -44.28 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 127.878 2.471 . . . . 0.0 115.116 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p -44.3 -47.55 9.51 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.928 0.891 . . . . 0.0 111.182 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.423 ' CD2' HD11 ' A' ' 118' ' ' ILE . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ILE . . . . . 0.423 HD11 ' CD2' ' A' ' 107' ' ' PHE . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.457 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -79.54 103.67 9.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -81.05 -18.67 45.9 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 111.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -93.41 -28.01 16.39 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.218 0.463 . . . . 0.0 111.864 -171.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 74.67 35.37 0.67 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.488 2.315 . . . . 0.0 113.412 174.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -89.67 -5.71 56.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.591 0.757 . . . . 0.0 111.678 169.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 67.08 37.47 3.77 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.527 1.131 . . . . 0.0 110.601 -176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.514 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.867 HD23 ' CE1' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 121.269 0.557 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -79.13 62.49 3.54 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.714 0.805 . . . . 0.0 110.265 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -172.06 -44.6 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.511 1.524 . . . . 0.0 109.703 169.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -43.21 -51.24 6.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.443 1.497 . . . . 0.0 112.203 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.68 -38.84 70.17 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt -79.36 -46.32 23.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.58 ' HA ' HD21 ' A' ' 168' ' ' LEU . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.867 ' CE1' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 -56.32 -25.96 50.61 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 -31.75 72.05 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.051 0.842 . . . . 0.0 111.491 173.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.32 65.54 2.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.63 0.772 . . . . 0.0 110.081 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -75.83 64.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.168 0.987 . . . . 0.0 111.028 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.339 -1.315 . . . . 0.0 110.252 171.172 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.9 m -73.4 40.35 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.993 1.317 . . . . 0.0 114.294 -171.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.23 -48.49 79.0 Favored Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -48.2 77.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.1 0.56 . . . . 0.0 110.131 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -57.84 -53.76 54.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.816 0.446 . . . . 0.0 109.847 176.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.79 -51.55 55.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.903 0.32 . . . . 0.0 110.316 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -52.53 -50.51 62.72 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.423 0.289 . . . . 0.0 110.838 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.421 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -68.7 106.19 2.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -91.63 -4.75 54.88 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -93.28 -26.74 17.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.725 0.693 . . . . 0.0 111.115 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 24.7 t0 65.94 36.84 5.72 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.657 2.383 . . . . 0.0 113.829 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -109.96 6.07 22.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.941 0.896 . . . . 0.0 112.622 172.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 85.65 -5.1 0.85 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 127.425 2.29 . . . . 0.0 113.824 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.407 ' HE3' HD13 ' A' ' 168' ' ' LEU . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.684 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -53.69 -48.51 69.46 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.574 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -50.92 -55.58 16.47 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -56.85 -49.47 75.37 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.421 0.555 . . . . 0.0 110.271 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.5 tp -49.59 -46.89 49.64 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.444 0.698 . . . . 0.0 111.38 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp -78.92 -60.52 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 118.684 0.675 . . . . 0.0 110.407 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.448 HD13 HD22 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.684 ' CE1' HD23 ' A' ' 168' ' ' LEU . 16.4 m-30 -57.59 -34.36 69.16 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -68.09 -59.1 3.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.895 0.771 . . . . 0.0 111.058 171.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -61.67 -26.69 68.18 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -170.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -58.34 -30.24 66.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.843 0.457 . . . . 0.0 111.351 174.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.876 -1.535 . . . . 0.0 110.579 175.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.251 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.6 p -76.16 66.7 2.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.634 0.773 . . . . 0.0 110.046 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -77.68 -161.26 15.17 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 109.926 -1.269 . . . . 0.0 109.926 170.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.7 mp0 -74.86 60.56 0.96 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.134 0.974 . . . . 0.0 109.922 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 23.7 mtp-105 -75.33 73.9 2.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.866 0.867 . . . . 0.0 109.738 -176.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -39.17 -47.38 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.152 1.381 . . . . 0.0 111.734 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m 71.12 -56.43 0.63 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.862 1.665 . . . . 0.0 112.2 178.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ALA . . . . . 0.401 ' HB3' HD13 ' A' ' 154' ' ' ILE . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -81.28 102.18 10.23 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -67.72 -27.59 66.93 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.951 -0.468 . . . . 0.0 109.799 169.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 31.9 p30 -75.26 -14.92 60.55 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.605 0.762 . . . . 0.0 112.452 175.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.1 t0 29.62 51.23 0.08 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.803 2.041 . . . . 0.0 114.525 -169.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -117.54 15.22 14.63 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.94 0.896 . . . . 0.0 111.942 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 79.63 -15.7 0.73 Allowed 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.495 1.918 . . . . 0.0 114.382 -177.561 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.401 HD13 ' HB3' ' A' ' 146' ' ' ALA . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.409 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.13 79.04 1.75 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.657 0.783 . . . . 0.0 109.462 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.53 62.82 0.77 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.662 0.785 . . . . 0.0 111.63 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -54.07 -33.23 56.94 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.5 -0.75 . . . . 0.0 112.122 -176.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -56.94 -20.7 24.99 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp -55.04 -19.85 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.715 -0.616 . . . . 0.0 111.131 171.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -83.83 77.22 9.93 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -74.49 61.33 0.93 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.987 1.315 . . . . 0.0 110.664 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -162.89 158.09 22.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.995 1.718 . . . . 0.0 106.635 -174.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 66.79 -65.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.482 1.513 . . . . 0.0 111.767 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 C--O 1.249 1.068 0 CA-C-O 116.849 -1.548 . . . . 0.0 108.554 177.601 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.951 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 21.8 p -76.05 64.5 1.94 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.926 0.891 . . . . 0.0 108.614 174.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 70.35 -69.58 0.68 Allowed Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -169.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.02 154.77 36.79 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtp85 -69.59 72.16 0.34 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.278 0.631 . . . . 0.0 112.019 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -75.01 70.85 2.05 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m -43.94 -38.35 3.38 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.366 1.066 . . . . 0.0 112.587 -173.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' PHE . . . . . 0.43 ' CZ ' HD12 ' B' ' 251' ' ' LEU . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -70.15 135.26 48.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.09 15.67 4.19 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.599 174.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -113.2 -31.86 6.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.718 1.207 . . . . 0.0 111.166 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 21.9 t0 84.39 13.95 0.27 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.56 2.344 . . . . 0.0 114.14 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -66.83 -15.84 63.87 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 120.901 -1.124 . . . . 0.0 110.128 169.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 67.28 42.01 2.36 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.267 1.827 . . . . 0.0 110.633 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.464 ' CG2' HD12 ' A' ' 168' ' ' LEU . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.682 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.848 0.356 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 85.2 tttt 41.12 -98.59 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.663 1.985 . . . . 0.0 112.051 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -38.9 -52.48 1.76 Allowed 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.006 1.322 . . . . 0.0 110.566 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -46.61 -50.45 17.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.6 1.16 . . . . 0.0 110.776 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.24 -38.39 83.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.92 0.488 . . . . 0.0 110.348 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.79 -53.34 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -174.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 251' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 110' ' ' PHE . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.404 HD22 ' CZ ' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.682 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.4 m-85 -67.54 -22.25 65.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -76.88 -16.69 59.33 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.421 1.488 . . . . 0.0 111.293 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -51.25 124.8 12.5 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 118.888 0.767 . . . . 0.0 111.83 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -75.99 64.64 1.92 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.643 0.777 . . . . 0.0 109.247 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 22.7 tptm . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.04 -1.457 . . . . 0.0 110.965 -175.022 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.309 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.1 p -72.74 75.88 1.12 Allowed 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.098 -0.648 . . . . 0.0 109.477 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -48.64 -47.76 29.67 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -91.52 95.71 10.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . 0.417 ' H ' ' NE ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -64.52 130.52 44.01 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.897 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.91 150.53 45.64 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m -40.52 -48.0 2.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.038 1.335 . . . . 0.0 113.095 176.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' A' ' 154' ' ' ILE . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ALA . . . . . 0.562 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -77.89 103.91 8.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.3 ptt85 -84.56 -18.38 35.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.238 0.615 . . . . 0.0 111.501 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -83.44 -14.26 52.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.424 0.556 . . . . 0.0 111.977 -178.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 p30 60.21 16.77 6.35 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.081 2.553 . . . . 0.0 115.977 174.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.9 6.15 49.56 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.282 0.946 . . . . 0.0 112.334 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER 83.86 -8.94 1.01 Allowed 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 128.151 2.58 . . . . 0.0 113.708 -177.184 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 143' ' ' ILE . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.69 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.5 tptm . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.63 -171.74 2.79 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.869 1.268 . . . . 0.0 108.61 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 67.62 -68.55 0.16 Allowed 'General case' 0 C--O 1.227 -0.096 0 C-N-CA 125.698 1.599 . . . . 0.0 110.695 -169.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -64.17 -29.06 70.19 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.108 0.963 . . . . 0.0 111.195 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.8 mp -75.44 75.33 2.51 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm -48.06 -39.99 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 125.298 1.439 . . . . 0.0 111.722 -169.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 168' ' ' LEU . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.69 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.0 m-30 -74.0 34.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -75.23 -30.76 60.64 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 121.131 -0.98 . . . . 0.0 110.608 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.9 t70 69.08 -58.02 0.51 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 127.254 2.222 . . . . 0.0 111.609 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -68.47 75.56 0.26 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.751 1.62 . . . . 0.0 109.325 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt . . . . . 0 C--O 1.25 1.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.127 176.058 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 111.546 -0.622 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.7 m -64.77 -31.61 72.92 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.831 0.452 . . . . 0.0 111.737 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.64 -69.16 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.53 148.51 37.64 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.438 0.695 . . . . 0.0 110.858 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -76.73 41.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.131 0.972 . . . . 0.0 112.817 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -102.09 -63.5 1.15 Allowed 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 102.504 -3.147 . . . . 0.0 102.504 168.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m 44.74 36.02 1.66 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.387 1.475 . . . . 0.0 112.205 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.411 HG21 ' HA ' ' A' ' 152' ' ' ASN . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -64.17 101.48 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -72.25 -10.3 59.6 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.8 -0.563 . . . . 0.0 112.179 -173.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -108.73 -7.25 15.62 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.854 0.862 . . . . 0.0 112.701 172.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.4 t0 42.57 41.8 2.51 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.402 1.881 . . . . 0.0 114.841 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -73.56 -31.06 63.43 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.042 -1.036 . . . . 0.0 110.829 170.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ASN . . . . . 0.411 ' HA ' HG21 ' A' ' 143' ' ' ILE 0.28 30.4 m-80 109.85 26.41 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 130.269 3.428 . . . . 0.0 111.759 -176.441 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.478 ' HB ' HD12 ' A' ' 168' ' ' LEU . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.513 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 111.208 0.077 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -52.32 123.44 10.81 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 70.44 -58.72 0.54 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.661 1.585 . . . . 0.0 111.005 -173.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -42.52 -49.82 5.33 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.831 1.652 . . . . 0.0 112.484 -177.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.5 tt -51.21 -42.94 61.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.28 1.032 . . . . 0.0 111.297 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt -82.25 -45.37 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.513 ' CE1' HD23 ' A' ' 168' ' ' LEU . 6.7 m-85 -85.3 38.22 0.72 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -70.42 -47.8 59.03 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.201 -170.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 43.1 t0 65.56 166.27 0.18 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.07 1.348 . . . . 0.0 111.114 -172.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -75.11 69.63 2.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.277 1.031 . . . . 0.0 109.577 -179.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 59.7 mttp . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.292 -1.337 . . . . 0.0 110.405 172.985 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 111.156 -0.777 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.8 m -65.38 67.32 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.277 1.831 . . . . 0.0 113.529 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 37.02 -121.86 0.8 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.826 2.155 . . . . 0.0 113.177 172.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -57.46 -43.61 84.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.443 0.697 . . . . 0.0 111.106 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -41.67 96.52 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.04 -48.66 67.63 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 122.169 -0.332 . . . . 0.0 110.181 173.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -49.58 -43.51 46.28 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 122.757 0.423 . . . . 0.0 110.609 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.67 ' HA ' HD11 ' A' ' 154' ' ' ILE . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -55.67 120.07 6.7 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.4 ptt-85 -79.37 -25.49 42.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -120.5 0.48 10.51 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -169.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.7 t0 59.9 27.42 16.77 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.854 1.261 . . . . 0.0 112.797 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -69.92 -9.78 56.2 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.7 -1.25 . . . . 0.0 111.242 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 70.68 34.05 2.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.949 2.1 . . . . 0.0 111.522 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' ILE . . . . . 0.67 HD11 ' HA ' ' A' ' 143' ' ' ILE . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 168' ' ' LEU . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.565 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.24 -37.46 47.18 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.886 0.475 . . . . 0.0 111.528 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -55.44 -20.13 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -53.1 -38.22 62.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.694 1.588 . . . . 0.0 111.189 170.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.15 -11.09 27.05 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.454 0.701 . . . . 0.0 112.352 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm -107.61 -54.31 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.92 1.288 . . . . 0.0 108.531 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 246' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' B' ' 249' ' ' HIS . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.481 ' HA ' HD21 ' A' ' 168' ' ' LEU 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.565 ' CE1' HD23 ' A' ' 168' ' ' LEU . 10.8 m-30 -66.75 -28.27 68.28 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.48 -45.97 61.08 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.674 0.79 . . . . 0.0 110.36 170.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.29 64.75 0.81 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.71 0.804 . . . . 0.0 111.519 -176.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -73.47 71.17 1.3 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.052 0.941 . . . . 0.0 110.005 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.092 -1.432 . . . . 0.0 110.821 174.493 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.297 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.9 p -12.02 -76.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 128.394 2.678 . . . . 0.0 113.968 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -126.64 29.47 4.46 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.267 1.413 . . . . 0.0 110.881 173.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -81.24 58.12 3.44 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.68 0.792 . . . . 0.0 110.025 -172.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 70.6 mmt-85 -78.37 49.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.628 0.771 . . . . 0.0 111.309 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -71.6 149.96 45.14 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -39.44 -47.84 1.88 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.313 1.445 . . . . 0.0 112.387 175.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.41 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -58.2 103.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -65.85 -16.91 64.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -169.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 37.1 p30 -114.14 0.63 14.32 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.524 0.602 . . . . 0.0 112.461 177.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.1 t0 44.74 44.74 7.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.584 1.154 . . . . 0.0 113.299 -175.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -77.67 -17.69 57.43 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.483 -0.761 . . . . 0.0 111.714 174.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 103.1 17.8 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.489 3.115 . . . . 0.0 112.271 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.521 ' CE ' HD13 ' A' ' 168' ' ' LEU . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.658 ' HB ' HD12 ' A' ' 168' ' ' LEU . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -74.52 76.48 1.96 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -36.0 -46.18 0.47 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.956 2.102 . . . . 0.0 111.919 -178.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -32.34 -52.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.135 2.174 . . . . 0.0 112.549 173.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.71 -39.23 76.75 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.02 0.528 . . . . 0.0 111.423 -176.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt -81.14 -46.01 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -178.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.696 ' CE1' HD23 ' A' ' 168' ' ' LEU . 15.4 m-30 -65.13 -17.18 64.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -48.44 -29.36 3.99 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.96 0.8 . . . . 0.0 110.914 169.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.5 -21.94 18.91 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -56.14 132.96 51.76 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.016 0.825 . . . . 0.0 111.358 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.25 -1.357 . . . . 0.0 109.332 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.291 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.1 t 59.91 -152.73 0.39 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.669 0.788 . . . . 0.0 110.156 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.95 -65.76 2.21 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -75.04 61.92 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.247 1.019 . . . . 0.0 109.707 176.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -76.22 67.48 2.49 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.794 0.837 . . . . 0.0 108.887 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -78.19 58.69 2.1 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.546 -0.721 . . . . 0.0 109.657 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m -47.27 -38.45 12.47 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.638 1.175 . . . . 0.0 110.896 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -76.92 104.93 7.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -86.23 -7.13 58.76 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.043 -0.503 . . . . 0.0 112.351 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -102.97 -28.47 12.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.235 0.614 . . . . 0.0 112.212 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.5 t0 75.55 38.18 0.4 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.571 2.348 . . . . 0.0 113.65 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -95.96 -0.78 50.26 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.668 0.787 . . . . 0.0 112.345 169.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 79.3 12.8 1.21 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.835 2.054 . . . . 0.0 113.382 -176.87 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.426 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.673 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 120.174 0.035 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -70.75 79.06 0.61 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.941 0.896 . . . . 0.0 109.273 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 241' ' ' ARG . . . . . 0.429 ' NE ' ' H ' ' B' ' 241' ' ' ARG . 0.1 OUTLIER -55.29 -20.76 12.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.569 1.147 . . . . 0.0 113.341 -174.878 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 47.5 mp0 -45.98 -43.3 14.05 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.079 0.951 . . . . 0.0 110.414 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 89.5 mt -56.98 -36.5 70.41 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.889 0.476 . . . . 0.0 111.119 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt -73.56 -53.56 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 252' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 168' ' ' LEU . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.673 ' CE1' HD23 ' A' ' 168' ' ' LEU . 9.0 m-30 -74.25 46.12 0.24 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -164.57 88.41 0.49 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.044 0.938 . . . . 0.0 109.091 -170.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.76 146.24 17.54 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 169.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -76.04 63.2 1.75 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.558 0.743 . . . . 0.0 110.546 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.295 -1.336 . . . . 0.0 110.283 175.377 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.023 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.8 m -75.15 73.96 2.29 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.2 0.6 . . . . 0.0 110.996 -177.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 58.19 -112.38 3.87 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.319 1.437 . . . . 0.0 111.274 172.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -53.36 -36.55 61.5 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.344 0.658 . . . . 0.0 110.46 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -78.08 72.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -53.05 155.86 2.35 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.354 1.062 . . . . 0.0 110.477 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p -44.87 -49.22 11.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.051 0.941 . . . . 0.0 110.999 176.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -71.89 102.41 2.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -62.76 -19.41 63.95 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -175.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -111.18 0.38 16.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.085 0.857 . . . . 0.0 112.48 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.9 t70 44.61 35.58 1.45 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.303 1.441 . . . . 0.0 114.44 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -69.49 -5.89 27.04 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.655 -1.278 . . . . 0.0 111.365 170.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 77.03 28.95 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.635 2.374 . . . . 0.0 111.44 177.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' THR . . . . . 0.442 ' CG2' HD12 ' A' ' 168' ' ' LEU . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.622 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 120.427 0.156 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -55.51 120.11 6.68 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -77.93 68.97 4.09 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -41.1 -48.27 3.31 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 126.254 1.821 . . . . 0.0 112.11 -172.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 85.9 mt -45.89 -46.72 16.06 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.76 0.824 . . . . 0.0 112.1 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt -88.13 -49.22 14.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 249' ' ' HIS . . . . . 0.426 ' CE1' HG22 ' A' ' 166' ' ' THR . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.622 ' CE1' HD23 ' A' ' 168' ' ' LEU . 12.0 m-30 -64.58 -34.81 79.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.32 -44.97 93.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.565 0.621 . . . . 0.0 110.629 169.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -57.3 -47.82 80.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.565 0.62 . . . . 0.0 110.747 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.34 -47.16 85.44 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.954 0.901 . . . . 0.0 110.147 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 51.4 tttm . . . . . 0 C--O 1.252 1.193 0 CA-C-O 116.649 -1.643 . . . . 0.0 110.115 -176.802 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.1 m -74.71 66.73 1.5 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.78 0.832 . . . . 0.0 110.372 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 67.78 20.18 72.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.443 0.545 . . . . 0.0 111.954 -171.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.88 64.8 8.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.773 1.229 . . . . 0.0 109.984 -174.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.4 mmp_? 48.96 35.22 6.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.651 1.58 . . . . 0.0 113.404 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -70.48 148.37 48.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 171.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.15 -51.79 0.18 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.501 1.92 . . . . 0.0 112.252 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.522 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -75.75 116.72 16.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -109.09 -3.26 17.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.135 0.974 . . . . 0.0 111.976 172.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -100.03 -28.36 13.1 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.477 0.711 . . . . 0.0 111.52 -175.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 82.89 29.09 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.442 2.297 . . . . 0.0 113.016 170.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -83.65 -11.66 56.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.799 0.84 . . . . 0.0 112.078 169.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.62 33.71 4.89 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.284 1.433 . . . . 0.0 111.335 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' MET . . . . . 0.476 ' CE ' HD13 ' A' ' 168' ' ' LEU . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' LEU . . . . . 0.646 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 121.22 0.533 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -53.03 -35.73 59.76 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.291 1.036 . . . . 0.0 112.016 -175.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 27.4 mtm105 -58.99 -38.71 79.81 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.647 0.379 . . . . 0.0 111.648 176.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -85.51 -39.37 17.53 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.631 0.773 . . . . 0.0 109.986 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.87 73.05 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm -41.65 -44.94 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 126.359 1.864 . . . . 0.0 112.979 -169.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 253' ' ' PHE . . . . . 0.646 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.2 m-30 -67.37 -37.72 83.63 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 19.58 73.28 0.02 OUTLIER 'General case' 0 C--N 1.342 0.278 0 C-N-CA 128.391 2.677 . . . . 0.0 114.091 -175.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -47.02 -33.09 4.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.754 0.822 . . . . 0.0 112.818 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -68.83 80.2 0.3 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.335 0.654 . . . . 0.0 110.046 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.929 1.692 . . . . 0.0 108.304 169.747 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.453 -0.297 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 . . . . . 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.453 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.522 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.523 ' HB ' HD12 ' A' ' 168' ' ' LEU . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.557 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 CA--C 1.53 0.18 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.413 ' N ' HD11 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.5 m-30 . . . . . 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 CA--C 1.534 0.363 0 CA-C-O 121.162 0.506 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.474 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 68.2 m-20 . . . . . 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.117 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.524 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt . . . . . 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 168' ' ' LEU . 1.7 m-30 . . . . . 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.45 -0.438 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.485 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 . . . . . 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 . . . . . 0 CA--C 1.534 0.332 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.431 HG23 ' HG2' ' B' ' 245' ' ' GLU . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.702 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp . . . . . 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' A' ' 166' ' ' THR . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 168' ' ' LEU . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.702 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.5 m-30 . . . . . 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 N--CA 1.46 0.069 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.531 0.229 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.7 m-30 . . . . . 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 CA--C 1.53 0.203 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 . . . . . 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 121.002 0.429 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.489 ' HB ' HD12 ' A' ' 168' ' ' LEU . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.545 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.545 ' CE1' HD23 ' A' ' 168' ' ' LEU . 7.1 m-30 . . . . . 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.728 0.27 . . . . 0.0 111.728 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 CA-C-O 121.622 0.725 . . . . 0.0 110.183 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.423 ' CE ' HD13 ' A' ' 168' ' ' LEU . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.798 ' HB ' HD12 ' A' ' 168' ' ' LEU . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.798 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.43 ' HB2' ' CE2' ' B' ' 253' ' ' PHE 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.57 HD13 HD22 ' A' ' 168' ' ' LEU . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.43 ' CE2' ' HB2' ' B' ' 249' ' ' HIS . 10.7 m-30 . . . . . 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 CA--C 1.535 0.402 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . 0.469 ' CE2' HD21 ' B' ' 252' ' ' LEU . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 . . . . . 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.19 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.505 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.409 HG22 ' CE1' ' B' ' 249' ' ' HIS . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.707 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt . . . . . 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.409 ' CE1' HG22 ' A' ' 166' ' ' THR . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 168' ' ' LEU . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.707 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.5 m-30 . . . . . 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.163 0.506 . . . . 0.0 111.808 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt . . . . . 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.703 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.2 p90 . . . . . 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.452 -0.352 0 N-CA-C 110.74 -0.096 . . . . 0.0 110.74 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER . . . . . 0 N--CA 1.453 -0.303 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.56 ' CE ' HD13 ' A' ' 168' ' ' LEU . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.664 ' HB ' HD12 ' A' ' 168' ' ' LEU . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.664 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.533 0.291 0 CA-C-O 119.953 -0.07 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . 0.423 ' CD2' HD11 ' A' ' 118' ' ' ILE . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . 0.423 HD11 ' CD2' ' A' ' 107' ' ' PHE . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.457 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 . . . . . 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 . . . . . 0 CA--C 1.537 0.454 0 CA-C-O 121.369 0.604 . . . . 0.0 110.601 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.514 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.867 HD23 ' CE1' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt . . . . . 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.58 ' HA ' HD21 ' A' ' 168' ' ' LEU . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.867 ' CE1' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 . . . . . 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 CA--C 1.53 0.193 0 CA-C-O 119.783 -0.151 . . . . 0.0 110.838 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.421 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 . . . . . 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.328 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.407 ' HE3' HD13 ' A' ' 168' ' ' LEU . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.684 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp . . . . . 0 CA--C 1.536 0.406 0 CA-C-O 121.148 0.499 . . . . 0.0 110.407 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.448 HD13 HD22 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.684 ' CE1' HD23 ' A' ' 168' ' ' LEU . 16.4 m-30 . . . . . 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 CA--C 1.532 0.285 0 N-CA-C 112.2 0.444 . . . . 0.0 112.2 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . 0.401 ' HB3' HD13 ' A' ' 154' ' ' ILE . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 . . . . . 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER . . . . . 0 C--O 1.228 -0.037 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.401 HD13 ' HB3' ' A' ' 146' ' ' ALA . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.409 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp . . . . . 0 CA--C 1.536 0.419 0 CA-C-O 119.824 -0.132 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m . . . . . 0 C--O 1.225 -0.209 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . 0.43 ' CZ ' HD12 ' B' ' 251' ' ' LEU . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 122.172 0.987 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.464 ' CG2' HD12 ' A' ' 168' ' ' LEU . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.682 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 110' ' ' PHE . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.404 HD22 ' CZ ' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.682 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.4 m-85 . . . . . 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' A' ' 154' ' ' ILE . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . 0.562 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 . . . . . 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.106 0 N-CA-C 113.708 1.003 . . . . 0.0 113.708 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 143' ' ' ILE . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.69 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 111.722 0.267 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 168' ' ' LEU . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.69 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.0 m-30 . . . . . 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m . . . . . 0 CA--C 1.533 0.31 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.411 HG21 ' HA ' ' A' ' 152' ' ' ASN . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 . . . . . 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . 0.411 ' HA ' HG21 ' A' ' 143' ' ' ILE 0.28 30.4 m-80 . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.478 ' HB ' HD12 ' A' ' 168' ' ' LEU . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.513 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt . . . . . 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.513 ' CE1' HD23 ' A' ' 168' ' ' LEU . 6.7 m-85 . . . . . 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 C--O 1.225 -0.201 0 CA-C-O 119.334 -0.365 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . 0.67 ' HA ' HD11 ' A' ' 154' ' ' ILE . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 . . . . . 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.483 0.659 . . . . 0.0 111.522 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . 0.67 HD11 ' HA ' ' A' ' 143' ' ' ILE . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 168' ' ' LEU . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.565 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm . . . . . 0 CA--C 1.534 0.334 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' B' ' 249' ' ' HIS . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.481 ' HA ' HD21 ' A' ' 168' ' ' LEU 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.565 ' CE1' HD23 ' A' ' 168' ' ' LEU . 10.8 m-30 . . . . . 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.41 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.521 ' CE ' HD13 ' A' ' 168' ' ' LEU . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.658 ' HB ' HD12 ' A' ' 168' ' ' LEU . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt . . . . . 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.696 ' CE1' HD23 ' A' ' 168' ' ' LEU . 15.4 m-30 . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m . . . . . 0 C--O 1.224 -0.267 0 CA-C-O 119.704 -0.189 . . . . 0.0 110.896 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 . . . . . 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.426 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.673 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt . . . . . 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 168' ' ' LEU . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.673 ' CE1' HD23 ' A' ' 168' ' ' LEU . 9.0 m-30 . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p . . . . . 0 N--CA 1.452 -0.342 0 CA-C-O 119.428 -0.32 . . . . 0.0 110.999 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 . . . . . 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.572 0.225 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . 0.442 ' CG2' HD12 ' A' ' 168' ' ' LEU . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.622 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt . . . . . 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . 0.426 ' CE1' HG22 ' A' ' 166' ' ' THR . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.622 ' CE1' HD23 ' A' ' 168' ' ' LEU . 12.0 m-30 . . . . . 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLU . . . . . 0.522 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 . . . . . 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 . . . . . 0 CA--C 1.535 0.394 0 CA-C-O 120.955 0.407 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' MET . . . . . 0.476 ' CE ' HD13 ' A' ' 168' ' ' LEU . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' LEU . . . . . 0.646 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm . . . . . 0 N--CA 1.464 0.254 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 253' ' ' PHE . . . . . 0.646 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.2 m-30 . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.451 -0.66 . . . . 0.0 111.451 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 11.4 p -70.19 -61.47 1.76 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.818 0.847 . . . . 0.0 109.401 177.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 56.57 -101.97 0.17 Allowed Glycine 0 CA--C 1.526 0.739 0 C-N-CA 125.159 1.361 . . . . 0.0 110.507 177.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.4 mp0 -62.58 -52.04 64.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 174.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -82.43 66.23 7.93 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 123.808 0.843 . . . . 0.0 108.948 -175.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -124.43 155.57 38.63 Favored 'General case' 0 C--O 1.231 0.091 0 C-N-CA 124.172 0.989 . . . . 0.0 111.312 -173.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -45.07 -30.21 1.04 Allowed 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 127.255 2.222 . . . . 0.0 113.178 174.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 26.9 ttp-105 -42.54 -47.14 5.09 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.752 1.221 . . . . 0.0 111.049 169.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.6 mm-40 -56.25 -53.01 62.31 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.014 -0.429 . . . . 0.0 110.1 177.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -61.59 -45.61 93.36 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.24 0.616 . . . . 0.0 110.324 -175.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -49.48 -50.61 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 C-N-CA 123.567 0.747 . . . . 0.0 109.277 171.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.66 -40.66 95.83 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 110.468 -0.197 . . . . 0.0 110.468 -175.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 24.6 mmtp -56.21 -52.1 65.65 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.48 -0.763 . . . . 0.0 110.068 172.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.25 -44.21 79.47 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.464 0.306 . . . . 0.0 111.393 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -53.71 -52.88 58.67 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.871 0.868 . . . . 0.0 109.795 176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 27.9 mmm180 -59.39 -50.43 74.0 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 119.429 -0.319 . . . . 0.0 111.426 178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.16 -42.22 80.67 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.176 0.444 . . . . 0.0 109.862 -179.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.5 m-30 -64.15 -47.61 79.22 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 119.241 -0.409 . . . . 0.0 111.343 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -75.44 58.57 1.01 Allowed 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.83 0.852 . . . . 0.0 111.993 -173.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -50.43 -48.23 56.35 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 125.612 1.565 . . . . 0.0 111.201 177.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -70.99 -6.45 38.96 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 113.083 0.771 . . . . 0.0 113.083 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 55.13 48.01 20.56 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.163 1.385 . . . . 0.0 112.013 177.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 67.2 m -79.9 -10.36 59.77 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.746 -0.596 . . . . 0.0 111.961 173.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.66 14.75 82.18 Favored Glycine 0 CA--C 1.532 1.132 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -169.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 49.3 p -158.05 149.02 20.92 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 127.726 2.41 . . . . 0.0 104.979 -174.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.4 mt -94.08 111.86 25.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.6 p -89.75 168.55 12.01 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 123.334 0.653 . . . . 0.0 111.794 -176.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.3 tt -53.58 -39.15 36.3 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 O-C-N 121.628 -0.67 . . . . 0.0 110.544 169.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -60.7 -48.0 83.75 Favored 'General case' 0 N--CA 1.454 -0.251 0 C-N-CA 122.883 0.473 . . . . 0.0 109.831 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -56.83 -50.71 71.57 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 110.305 -0.258 . . . . 0.0 110.305 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -58.14 -46.31 85.87 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 121.276 -0.17 . . . . 0.0 110.544 -179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.8 tpp180 -56.98 -49.4 75.83 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 31.8 tpt180 -53.67 -55.58 24.77 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.145 0.43 . . . . 0.0 110.391 179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -50.32 -55.88 5.11 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.189 0 C-N-CA 123.368 0.667 . . . . 0.0 109.766 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.82 -53.52 57.25 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.084 0.554 . . . . 0.0 110.25 -173.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -52.16 -50.57 61.55 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.384 1.073 . . . . 0.0 111.015 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -56.07 -43.48 78.02 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.268 0.485 . . . . 0.0 111.527 178.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.94 -24.66 65.2 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.976 -0.453 . . . . 0.0 111.928 175.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.93 -15.66 16.23 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 125.782 1.658 . . . . 0.0 111.531 -177.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 36.4 mm-40 -71.16 92.82 1.01 Allowed 'General case' 0 N--CA 1.447 -0.589 0 C-N-CA 124.777 1.231 . . . . 0.0 109.345 -176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -76.39 70.3 2.96 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 177.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.8 mt -73.79 146.91 43.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.499 0.666 . . . . 0.0 111.617 -176.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.9 p -83.3 162.2 21.21 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.73 1.212 . . . . 0.0 111.072 178.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 54.4 mp0 -47.73 -46.94 30.38 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 124.785 1.234 . . . . 0.0 109.865 172.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -65.99 -52.43 49.54 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.692 0.397 . . . . 0.0 110.535 -174.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -51.96 -50.7 60.69 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.834 0.349 . . . . 0.0 110.1 177.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 46.7 mt -58.62 -46.81 86.26 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.646 -0.421 . . . . 0.0 111.154 177.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.4 mt-30 -61.99 -34.54 76.35 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 119.332 0.969 . . . . 0.0 112.29 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -60.84 -49.81 75.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 118.732 0.697 . . . . 0.0 109.804 173.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 86.8 mtp -55.91 -51.5 67.41 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.24 -0.287 . . . . 0.0 110.812 176.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.7 mm -47.5 -61.67 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 C-N-CA 124.612 1.165 . . . . 0.0 108.157 175.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -59.02 -36.83 75.62 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 124.521 1.128 . . . . 0.0 111.351 -173.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -59.35 -37.92 79.08 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 122.906 0.482 . . . . 0.0 111.837 176.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.41 -36.0 12.72 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.661 0.615 . . . . 0.0 112.661 -176.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 30.4 t0 -72.84 121.62 20.26 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.262 1.425 . . . . 0.0 110.636 -169.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -124.7 16.1 8.75 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.484 1.514 . . . . 0.0 110.796 169.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 46.3 p30 -111.1 -15.9 13.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.341 1.456 . . . . 0.0 111.926 -175.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 34.6 m-20 61.53 29.78 18.47 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 126.399 1.88 . . . . 0.0 112.59 179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -109.55 -6.86 15.25 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.59 0.756 . . . . 0.0 112.761 177.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.26 0.0 OUTLIER 77.92 12.16 1.88 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.733 1.613 . . . . 0.0 113.759 177.539 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -129.6 131.43 46.5 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 178.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 10.6 mm -80.35 112.21 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -80.52 169.37 17.77 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.186 0.517 . . . . 0.0 110.264 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -54.55 -49.3 70.64 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.232 -174.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -56.02 -53.68 54.08 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.212 0.605 . . . . 0.0 111.19 179.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -55.72 -44.32 77.36 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.961 0.41 . . . . 0.0 110.76 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -63.34 -51.18 67.01 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 49.9 mt -47.44 -52.59 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 C-N-CA 123.777 0.831 . . . . 0.0 109.848 172.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 55.5 ttm-85 -52.15 -58.77 5.57 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.759 0.824 . . . . 0.0 111.021 179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.1 tt -68.1 -32.73 57.27 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 118.679 0.672 . . . . 0.0 112.1 -175.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.522 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.7 mmt -61.5 -41.44 97.29 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.902 -0.499 . . . . 0.0 110.865 176.37 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -65.64 -55.72 16.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.345 -0.243 . . . . 0.0 110.345 171.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -41.38 -50.26 3.81 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.201 1.4 . . . . 0.0 111.109 -179.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.523 ' HB ' HD12 ' A' ' 168' ' ' LEU . 6.0 m -88.31 -1.11 57.84 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.304 0.641 . . . . 0.0 112.23 -171.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 58.12 36.84 26.23 Favored 'General case' 0 CA--C 1.533 0.293 0 O-C-N 121.231 -0.918 . . . . 0.0 111.646 -169.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.557 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -78.7 -37.13 42.32 Favored 'General case' 0 C--O 1.228 -0.063 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 169.78 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.275 -1.345 . . . . 0.0 109.632 169.778 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -48.21 -47.99 35.24 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.08 0.552 . . . . 0.0 111.704 -174.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 7.5 tpt180 -44.63 -54.84 5.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.746 0.819 . . . . 0.0 111.211 175.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -61.85 -50.74 71.05 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 123.361 0.665 . . . . 0.0 109.579 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 93.0 mt -57.36 -37.31 72.41 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.36 0.264 . . . . 0.0 111.53 -177.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 62.4 mt -74.39 -51.02 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.932 0.893 . . . . 0.0 109.727 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -50.59 -41.91 55.19 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 122.894 0.478 . . . . 0.0 111.007 174.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.9 m -53.06 -28.43 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.536 0.734 . . . . 0.0 112.6 176.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -72.87 -50.12 25.86 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.228 0.922 . . . . 0.0 110.242 178.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -52.42 -47.6 66.24 Favored 'General case' 0 N--CA 1.466 0.375 0 N-CA-C 109.654 -0.499 . . . . 0.0 109.654 171.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.413 ' N ' HD11 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -50.94 -53.57 31.76 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 122.973 0.509 . . . . 0.0 110.183 173.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 24.8 ttt85 -63.93 -41.36 97.66 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 118.472 -0.775 . . . . 0.0 112.289 -174.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 30.7 mt -55.84 -52.13 65.1 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.183 0.901 . . . . 0.0 110.623 -175.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.5 mt -79.5 -46.5 17.29 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.557 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.5 m-30 -77.66 37.82 0.24 Allowed 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.485 -0.759 . . . . 0.0 111.068 178.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -83.75 60.88 6.01 Favored 'General case' 0 C--O 1.232 0.143 0 O-C-N 120.658 -1.276 . . . . 0.0 108.68 -178.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -67.89 79.1 0.21 Allowed 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.855 1.262 . . . . 0.0 110.386 -171.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 66.49 -70.63 0.1 Allowed 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.905 2.082 . . . . 0.0 108.472 -171.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt . . . . . 0 C--O 1.252 1.19 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.386 173.009 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.568 -0.613 . . . . 0.0 111.568 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 4.0 p -69.94 -68.91 0.38 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.986 0.914 . . . . 0.0 109.156 175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 42.83 -129.07 5.23 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 125.501 1.524 . . . . 0.0 111.896 179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.3 mp0 -67.82 -16.22 64.0 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.107 0.963 . . . . 0.0 112.694 -179.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -88.16 -69.26 0.71 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.504 -0.924 . . . . 0.0 108.504 -177.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 8.4 t70 43.92 -137.11 0.41 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.086 0.955 . . . . 0.0 110.162 -169.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 3.6 p -80.35 56.04 2.41 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.335 1.454 . . . . 0.0 109.73 178.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 19.0 ttm180 -52.94 -51.25 62.06 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 123.406 0.682 . . . . 0.0 110.777 -171.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.34 -50.06 60.2 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.098 0.408 . . . . 0.0 112.004 178.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 77.7 mm-40 -60.88 -52.19 66.08 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.294 0.568 . . . . 0.0 110.03 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 73.2 mt -51.19 -45.33 31.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.325 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -73.64 -40.82 63.48 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 123.402 0.681 . . . . 0.0 109.99 -171.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -54.53 -52.36 62.26 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.857 -0.527 . . . . 0.0 110.089 169.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.8 -46.35 78.03 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 122.238 -0.289 . . . . 0.0 111.759 176.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -51.47 -54.61 25.25 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.042 0.537 . . . . 0.0 109.906 176.529 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.59 -42.7 98.26 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 119.132 -0.461 . . . . 0.0 110.704 -175.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.38 -43.53 88.53 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.418 0.554 . . . . 0.0 109.889 175.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 9.2 m-30 -63.62 -46.06 87.44 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 119.203 -0.427 . . . . 0.0 111.707 176.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -76.02 58.55 1.2 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 118.822 0.737 . . . . 0.0 110.477 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -59.28 -35.14 73.21 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.818 0.847 . . . . 0.0 110.856 -179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -75.01 10.85 1.28 Allowed 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.258 0.623 . . . . 0.0 112.153 175.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 45.3 34.96 1.62 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 126.278 1.831 . . . . 0.0 113.028 173.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 20.3 m -85.34 6.71 25.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.103 0.561 . . . . 0.0 112.003 -169.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.24 -47.85 3.93 Favored Glycine 0 C--N 1.337 0.637 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.8 p -105.0 154.04 20.65 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 125.596 1.558 . . . . 0.0 108.313 170.078 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 18.9 mt -80.24 132.5 31.66 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 46.8 p -111.04 171.4 7.49 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 119.974 1.261 . . . . 0.0 111.155 177.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.29 -35.71 43.92 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 O-C-N 121.838 -0.539 . . . . 0.0 110.627 175.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.0 mttp -61.1 -49.14 78.52 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.525 0.73 . . . . 0.0 110.298 175.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -55.34 -50.97 68.27 Favored 'General case' 0 C--N 1.339 0.151 0 N-CA-C 109.576 -0.528 . . . . 0.0 109.576 176.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.5 mt -57.9 -47.99 81.18 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 119.406 -0.33 . . . . 0.0 110.96 -178.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 22.9 tpt180 -56.99 -46.87 81.96 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-O 118.759 -0.639 . . . . 0.0 109.865 175.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 56.5 ttm-85 -56.05 -54.14 48.49 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.825 0.739 . . . . 0.0 110.43 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.0 t -51.07 -56.1 5.68 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.152 0 C-N-CA 124.09 0.956 . . . . 0.0 109.684 177.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.83 -52.57 65.14 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.046 -0.525 . . . . 0.0 109.865 -174.489 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.69 -52.83 21.39 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 125.409 1.484 . . . . 0.0 111.271 174.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.62 -43.12 68.42 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 118.463 0.574 . . . . 0.0 111.452 178.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 77.2 mt -71.26 -18.06 62.45 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 176.056 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 91.71 2.36 69.83 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 124.902 1.239 . . . . 0.0 111.504 -171.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.474 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 74.0 mm-40 -75.9 91.09 2.98 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 172.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -76.46 70.37 3.02 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.516 -0.74 . . . . 0.0 109.717 -177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 91.9 mt -81.46 120.84 25.51 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -172.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 44.7 p -68.49 163.53 23.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.071 0.463 . . . . 0.0 110.129 -174.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -48.22 -48.1 35.2 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.271 0.628 . . . . 0.0 109.83 176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.429 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.2 mp0 -53.82 -56.66 15.6 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.284 1.034 . . . . 0.0 111.047 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.29 -45.42 80.2 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 122.902 0.481 . . . . 0.0 110.222 -176.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 93.1 mt -63.12 -42.45 99.53 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.844 175.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -55.91 -41.05 73.94 Favored 'General case' 0 N--CA 1.455 -0.215 0 O-C-N 121.898 -0.502 . . . . 0.0 110.291 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -59.04 -49.0 79.54 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.153 -0.342 . . . . 0.0 110.745 176.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.9 mtp -55.89 -53.26 58.93 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.234 0.54 . . . . 0.0 110.829 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -50.24 -54.38 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 125.277 1.431 . . . . 0.0 109.626 177.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.3 -41.92 98.92 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 123.593 0.757 . . . . 0.0 110.742 -176.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -61.05 -44.74 96.93 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 122.42 0.288 . . . . 0.0 111.042 177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.03 -46.27 24.33 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 112.745 0.646 . . . . 0.0 112.745 -175.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . 0.442 ' HB3' ' H ' ' A' ' 150' ' ' ASP . 68.2 m-20 -75.02 128.67 36.11 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.427 0.691 . . . . 0.0 112.363 -169.168 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 72.6 mtp85 -83.68 55.29 3.17 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 172.13 -57.33 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.111 1.765 . . . . 0.0 110.842 -175.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.442 ' H ' ' HB3' ' A' ' 147' ' ' ASP . 50.6 t0 79.6 57.0 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 127.385 2.274 . . . . 0.0 110.324 -171.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 24.3 p-10 -95.65 14.82 21.74 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.366 1.066 . . . . 0.0 111.334 170.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.286 0.0 OUTLIER 75.57 -8.69 1.55 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 126.478 1.911 . . . . 0.0 114.713 -173.29 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -103.7 120.6 41.26 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 119.376 0.989 . . . . 0.0 109.724 -174.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -88.82 107.7 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 169.585 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.8 p30 -84.32 168.57 15.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -57.68 -42.35 83.42 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.747 -0.644 . . . . 0.0 111.74 -176.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -56.75 -58.37 8.39 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 118.776 0.716 . . . . 0.0 110.123 177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -51.63 -46.73 63.77 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.565 0.746 . . . . 0.0 110.933 179.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.8 t80 -60.89 -52.16 66.24 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.284 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.6 mt -46.58 -50.69 5.2 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.456 0 C-N-CA 124.215 1.006 . . . . 0.0 110.591 171.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 20.4 mmt180 -54.94 -58.52 7.29 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 118.7 0.682 . . . . 0.0 110.516 177.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 2.5 tt -65.79 -33.66 65.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 C-N-CA 119.778 -0.769 . . . . 0.0 112.446 -172.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.524 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.5 OUTLIER -53.93 -42.82 69.24 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 123.158 0.583 . . . . 0.0 111.561 171.536 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 59.0 mtmt -69.53 -55.11 11.1 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 118.971 -0.538 . . . . 0.0 110.474 174.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -44.99 -48.5 11.49 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.43 0.692 . . . . 0.0 111.068 -177.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 4.9 m -86.82 -3.26 59.04 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 115.148 -0.933 . . . . 0.0 112.453 -171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.6 m 56.0 37.79 29.24 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.133 0.879 . . . . 0.0 111.635 -169.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.572 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.44 -41.22 28.06 Favored 'General case' 0 N--CA 1.455 -0.18 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 169.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 41.6 m-85 . . . . . 0 C--O 1.251 1.184 0 CA-C-O 116.88 -1.533 . . . . 0.0 109.103 169.85 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.878 0 CA-C-O 120.578 0.228 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.61 71.39 1.38 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 123.444 0.698 . . . . 0.0 109.965 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.8 mtm105 -42.41 -40.24 2.48 Favored 'General case' 0 C--N 1.34 0.175 0 C-N-CA 125.256 1.422 . . . . 0.0 111.805 -179.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -29.56 -52.28 0.12 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.642 1.977 . . . . 0.0 112.431 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 64.5 tp -55.37 -46.24 76.49 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.24 0.616 . . . . 0.0 111.043 -177.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 28.9 mt -76.78 -47.89 27.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 -176.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -50.25 -40.99 49.46 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.562 1.145 . . . . 0.0 111.304 177.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 70.5 m -50.87 -31.55 17.73 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.262 0.625 . . . . 0.0 112.616 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 76.7 mttt -77.07 -55.55 5.35 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 121.708 -0.62 . . . . 0.0 109.539 -178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.0 m95 -50.09 -45.97 53.07 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.428 0.691 . . . . 0.0 110.252 174.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -49.49 -68.31 0.19 Allowed 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.972 1.309 . . . . 0.0 108.858 169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.5 tpp180 -53.77 -40.53 66.31 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -171.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.0 mt -60.5 -31.5 70.55 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.716 0.689 . . . . 0.0 112.496 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.9 mt -100.97 -54.08 2.89 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.572 ' CE1' HD23 ' A' ' 168' ' ' LEU . 1.7 m-30 -74.08 51.88 0.43 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.098 0.959 . . . . 0.0 109.948 177.281 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 4.3 p80 -79.99 65.27 5.1 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 120.457 -1.402 . . . . 0.0 108.857 174.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -67.17 -36.41 81.74 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 171.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -76.22 53.89 0.84 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.138 0.975 . . . . 0.0 110.24 175.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.223 0 CA-C-O 117.975 -1.012 . . . . 0.0 111.406 177.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.074 0 N-CA-C 110.987 -0.845 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 73.9 m -74.31 72.08 1.77 Allowed 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 177.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 76.48 -57.88 3.34 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.195 -1.162 . . . . 0.0 110.195 -174.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.19 161.62 8.57 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.54 0.736 . . . . 0.0 110.197 171.25 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -55.61 148.98 14.77 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.971 1.308 . . . . 0.0 110.509 176.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -50.83 -34.04 26.14 Favored 'General case' 0 C--N 1.343 0.297 0 C-N-CA 124.019 0.928 . . . . 0.0 113.115 -174.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.2 m -43.27 -41.61 4.03 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 124.816 1.247 . . . . 0.0 112.263 172.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -58.65 -36.63 74.43 Favored 'General case' 0 C--N 1.341 0.226 0 CA-C-N 118.079 0.399 . . . . 0.0 111.506 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.74 -46.35 85.75 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-N 119.081 0.855 . . . . 0.0 109.291 179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -60.58 -49.37 77.8 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-O 121.392 0.615 . . . . 0.0 109.778 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 77.6 mt -50.78 -50.92 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.677 173.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.69 -39.36 84.45 Favored 'General case' 0 N--CA 1.451 -0.385 0 O-C-N 121.963 -0.46 . . . . 0.0 110.542 -171.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -55.23 -54.6 41.31 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.725 -0.609 . . . . 0.0 110.259 170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.29 -43.94 79.34 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.593 0.235 . . . . 0.0 111.543 178.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.35 -54.53 35.28 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.021 0.928 . . . . 0.0 109.865 177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.8 mmm-85 -63.3 -44.18 95.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 119.035 -0.507 . . . . 0.0 111.685 -179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -44.96 86.33 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 118.714 0.688 . . . . 0.0 109.658 178.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -62.88 -45.83 90.69 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 119.12 -0.467 . . . . 0.0 111.105 175.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -74.12 57.75 0.67 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.723 0.692 . . . . 0.0 110.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -62.52 -34.73 77.49 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.674 0.79 . . . . 0.0 110.549 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 58.6 m-20 -63.34 -16.88 61.75 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 122.0 -0.437 . . . . 0.0 111.157 174.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 8.5 m-80 56.2 43.65 26.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 125.303 1.441 . . . . 0.0 110.343 -177.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -83.75 6.76 19.99 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.247 1.019 . . . . 0.0 112.225 178.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.87 -46.46 3.66 Favored Glycine 0 CA--C 1.525 0.713 0 N-CA-C 109.885 -1.286 . . . . 0.0 109.885 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 36.1 p -106.34 155.17 19.8 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.483 1.513 . . . . 0.0 107.52 169.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.9 mt -81.45 147.38 6.25 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 106.047 -1.835 . . . . 0.0 106.047 169.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 72.9 p -130.19 168.32 17.01 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 123.894 0.878 . . . . 0.0 110.384 177.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -52.97 -36.68 24.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 122.013 -0.429 . . . . 0.0 111.188 172.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -59.86 -50.28 74.4 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 122.639 0.376 . . . . 0.0 110.086 176.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -55.22 -54.7 40.12 Favored 'General case' 0 CA--C 1.522 -0.131 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.1 mt -57.64 -47.57 81.87 Favored 'General case' 0 CA--C 1.529 0.159 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -174.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.4 tpt85 -60.3 -45.44 93.36 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 118.22 0.464 . . . . 0.0 110.618 178.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 -56.24 -57.01 14.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.145 0.578 . . . . 0.0 110.117 178.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 71.8 t -52.45 -52.12 28.32 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 C-N-CA 123.895 0.878 . . . . 0.0 109.729 177.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.485 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.67 -46.79 86.43 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.808 0.443 . . . . 0.0 110.613 -176.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -51.08 -51.2 55.7 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 123.594 0.757 . . . . 0.0 110.366 172.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -60.28 -41.1 92.63 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 67.4 mt -64.03 -25.32 68.06 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.154 0.434 . . . . 0.0 110.713 173.373 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 113.7 -31.49 6.56 Favored Glycine 0 CA--C 1.528 0.853 0 C-N-CA 126.014 1.769 . . . . 0.0 110.207 -178.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.485 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 51.2 mm-40 -66.58 92.07 0.2 Allowed 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.453 1.101 . . . . 0.0 109.549 -177.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -76.21 73.45 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 108.837 -0.801 . . . . 0.0 108.837 176.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.2 mt -64.65 141.29 58.83 Favored 'General case' 0 CA--C 1.527 0.072 0 C-N-CA 123.595 0.758 . . . . 0.0 110.542 -173.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 81.7 p -68.77 153.47 43.72 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-O 121.005 0.431 . . . . 0.0 110.262 177.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -50.9 -37.58 44.73 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 122.872 0.469 . . . . 0.0 110.486 170.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -58.43 -60.15 4.24 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.118 0.567 . . . . 0.0 110.475 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -51.27 -48.53 62.19 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 121.035 0.445 . . . . 0.0 110.855 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 75.8 mt -59.85 -45.66 91.72 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.099 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 34.3 mm-40 -63.48 -28.69 70.13 Favored 'General case' 0 C--O 1.22 -0.494 0 O-C-N 120.993 -1.067 . . . . 0.0 112.321 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -63.47 -50.53 69.35 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 120.912 1.687 . . . . 0.0 109.748 171.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 79.5 mtp -51.71 -55.46 19.44 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 122.854 0.461 . . . . 0.0 110.664 176.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.98 -54.08 39.66 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.454 0 C-N-CA 123.539 0.736 . . . . 0.0 110.237 -179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -61.63 -33.24 73.59 Favored 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 122.872 0.469 . . . . 0.0 110.581 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -73.2 -45.23 57.5 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 117.988 0.358 . . . . 0.0 111.648 173.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -69.71 -43.9 71.47 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.006 0.743 . . . . 0.0 113.006 -174.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -68.06 132.2 46.82 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.634 1.574 . . . . 0.0 108.987 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -116.01 -6.25 11.97 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.909 0.884 . . . . 0.0 112.163 174.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 34.2 p30 -111.99 -9.22 14.02 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.076 0.95 . . . . 0.0 112.934 -174.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 27.9 t0 64.46 35.22 9.63 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 126.998 2.119 . . . . 0.0 112.98 178.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -88.88 -11.39 44.74 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 171.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 70.04 25.95 4.67 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 126.326 1.851 . . . . 0.0 112.462 -176.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -122.45 172.71 8.14 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 127.089 2.155 . . . . 0.0 106.854 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -123.6 109.1 22.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 N-CA-C 106.863 -1.532 . . . . 0.0 106.863 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -85.75 173.36 10.13 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -50.26 -53.25 29.68 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 119.056 -0.497 . . . . 0.0 111.507 175.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -55.77 -53.83 51.92 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 118.754 0.706 . . . . 0.0 111.349 -176.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -53.48 -47.68 69.6 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.555 0.742 . . . . 0.0 110.846 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -62.61 -52.94 61.39 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.113 -178.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.4 mt -48.67 -50.85 12.57 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 124.605 1.162 . . . . 0.0 110.039 174.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 71.8 ttp85 -53.55 -58.6 6.58 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.408 0.683 . . . . 0.0 110.196 179.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.7 tt -64.95 -35.54 75.63 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.995 -0.682 . . . . 0.0 111.912 -176.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.2 OUTLIER -53.56 -46.96 70.44 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.475 0.71 . . . . 0.0 111.294 174.194 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.8 mttt -64.95 -55.91 16.34 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 172.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -46.0 -34.02 3.74 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 126.437 1.895 . . . . 0.0 113.268 -176.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.431 HG23 ' HG2' ' B' ' 245' ' ' GLU . 15.5 m -105.18 -3.74 22.6 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.341 1.057 . . . . 0.0 112.787 -173.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 6.9 m 61.69 32.01 18.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 119.086 0.857 . . . . 0.0 111.408 -169.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.702 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -77.08 -36.96 55.38 Favored 'General case' 0 CA--C 1.529 0.162 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 172.024 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 . . . . . 0 C--O 1.252 1.197 0 C-N-CA 124.784 1.234 . . . . 0.0 108.855 168.927 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm . . . . . 0 N--CA 1.474 0.733 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.2 mtpp -108.05 103.22 12.39 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 124.208 1.003 . . . . 0.0 108.36 175.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.13 63.77 6.5 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.718 0.807 . . . . 0.0 109.939 -170.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 78.3 mm-40 -30.04 -58.96 0.18 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 126.985 2.114 . . . . 0.0 113.926 -169.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 65.1 tp -51.08 -47.88 61.77 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.736 0.814 . . . . 0.0 112.07 -177.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 4.5 mp -79.71 -45.84 22.94 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.156 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 -177.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . 0.431 ' HG2' HG23 ' A' ' 166' ' ' THR . 62.8 mt-10 -48.93 -46.78 43.67 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 119.217 -0.421 . . . . 0.0 110.93 178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 68.4 m -45.9 -36.27 5.26 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.406 1.083 . . . . 0.0 112.677 177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -69.01 -63.31 1.09 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 43.3 m95 -52.92 -45.17 67.5 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.389 0.675 . . . . 0.0 111.348 177.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.9 t-80 -45.81 -66.0 0.46 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.633 1.573 . . . . 0.0 109.907 171.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -61.41 -36.55 80.64 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 117.8 0.273 . . . . 0.0 111.514 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -56.75 16.9 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 121.379 0.609 . . . . 0.0 110.06 177.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.443 HD13 HD22 ' A' ' 168' ' ' LEU . 0.9 OUTLIER -79.49 -57.26 3.78 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.249 -171.426 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.702 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.5 m-30 -71.43 62.95 0.37 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.754 1.621 . . . . 0.0 109.991 -177.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -170.11 -47.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 125.813 1.645 . . . . 0.0 108.452 -169.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.5 t70 46.29 -139.52 0.51 Allowed 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.2 1.4 . . . . 0.0 111.389 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp 69.09 -62.72 0.39 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.189 1.796 . . . . 0.0 110.944 -173.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 117.715 -1.136 . . . . 0.0 109.596 169.971 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.298 0 N-CA-C 111.559 -0.616 . . . . 0.0 111.559 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.4 m -49.87 -40.62 43.26 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.632 1.173 . . . . 0.0 112.513 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -73.26 65.76 1.6 Allowed Glycine 0 CA--C 1.53 0.97 0 N-CA-C 110.516 -1.034 . . . . 0.0 110.516 172.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -63.24 -49.26 74.85 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.784 0.834 . . . . 0.0 110.63 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.47 -68.92 0.37 Allowed 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 9.2 t70 36.95 -135.48 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 127.078 2.151 . . . . 0.0 112.059 178.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.6 p -73.47 -41.16 63.5 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 125.776 1.631 . . . . 0.0 109.449 172.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 33.5 ttm105 -42.42 -56.93 2.82 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 126.728 2.011 . . . . 0.0 112.175 -171.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -66.49 -35.88 81.37 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.736 -0.603 . . . . 0.0 111.709 -177.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -63.15 -49.48 74.16 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.35 -52.15 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 123.728 0.811 . . . . 0.0 109.656 173.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.65 -41.62 92.34 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 122.189 -0.319 . . . . 0.0 110.571 -172.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt -56.7 -48.85 76.76 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.349 -0.844 . . . . 0.0 110.837 171.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.97 -43.58 86.55 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.817 -0.552 . . . . 0.0 111.747 176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -53.72 -52.16 61.01 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 123.834 0.854 . . . . 0.0 109.76 175.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 26.4 mmm180 -57.65 -51.42 69.6 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.647 0.379 . . . . 0.0 111.31 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.98 -42.85 80.96 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 118.214 0.461 . . . . 0.0 110.104 -178.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -63.89 -51.19 65.69 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 119.083 -0.484 . . . . 0.0 111.463 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -74.77 62.75 1.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 118.85 0.75 . . . . 0.0 111.569 -175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -54.86 -40.08 69.29 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.465 1.106 . . . . 0.0 111.092 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -62.74 -13.79 36.88 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.19 40.25 28.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.844 1.258 . . . . 0.0 110.21 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 m -79.75 -16.79 54.93 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.037 0.535 . . . . 0.0 112.189 -177.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 91.21 -6.52 81.2 Favored Glycine 0 CA--C 1.531 1.055 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 -171.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.8 p -141.76 155.09 45.63 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.131 1.772 . . . . 0.0 106.472 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 8.9 mt -87.96 134.05 28.96 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 106.522 -1.658 . . . . 0.0 106.522 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 66.2 p -121.83 167.01 13.5 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.201 0.909 . . . . 0.0 110.593 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -48.32 -45.33 13.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.662 -0.649 . . . . 0.0 112.186 -177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -64.03 -36.53 84.29 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 123.095 0.558 . . . . 0.0 111.621 -179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -58.75 -50.67 73.06 Favored 'General case' 0 C--N 1.34 0.167 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 172.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 54.1 mt -59.93 -46.4 89.51 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 120.39 0.138 . . . . 0.0 110.912 -177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -58.5 -47.72 83.16 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.944 -0.472 . . . . 0.0 110.246 176.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 37.0 ttm105 -55.99 -51.67 66.93 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 28.5 t -50.09 -54.46 8.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 124.084 0.954 . . . . 0.0 109.832 176.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -50.11 -58.1 6.26 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 122.959 0.504 . . . . 0.0 110.248 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -49.6 -54.77 16.41 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.036 0.935 . . . . 0.0 110.806 179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -59.73 -38.44 81.7 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 122.809 0.444 . . . . 0.0 112.07 -177.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.6 mt -69.08 -13.76 62.62 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.243 0.474 . . . . 0.0 112.218 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 85.8 22.91 48.15 Favored Glycine 0 CA--C 1.529 0.916 0 C-N-CA 124.139 0.876 . . . . 0.0 111.271 -176.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -97.22 173.54 7.17 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 124.917 1.287 . . . . 0.0 109.263 173.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -139.32 92.94 2.63 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.211 -1.403 . . . . 0.0 107.211 169.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 82.5 mt -90.46 113.63 25.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 106.606 -1.628 . . . . 0.0 106.606 173.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 70.9 p -67.97 159.66 30.2 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.354 0.662 . . . . 0.0 109.542 -176.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -49.05 -40.27 30.81 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 122.708 0.403 . . . . 0.0 111.261 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -64.76 -56.11 15.63 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.771 0.428 . . . . 0.0 110.981 178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -50.38 -49.8 53.28 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-O 121.321 0.581 . . . . 0.0 110.173 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.7 mt -56.03 -49.8 72.7 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.761 176.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -60.49 -33.75 73.06 Favored 'General case' 0 C--O 1.226 -0.178 0 CA-C-N 119.681 1.128 . . . . 0.0 112.613 178.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -63.6 -48.51 77.06 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.498 0.59 . . . . 0.0 110.086 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 94.1 mtp -56.2 -51.65 67.29 Favored 'General case' 0 N--CA 1.464 0.265 0 O-C-N 121.942 -0.474 . . . . 0.0 111.371 176.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.1 mm -48.89 -59.73 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 C-N-CA 125.302 1.441 . . . . 0.0 108.496 175.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.18 -39.02 85.05 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.386 0.674 . . . . 0.0 110.895 -173.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -60.49 -50.8 72.12 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.246 0.619 . . . . 0.0 111.171 174.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -77.81 -44.28 27.96 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.878 0.871 . . . . 0.0 113.1 -171.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -78.65 105.39 9.91 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.304 1.842 . . . . 0.0 110.388 -169.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 10.4 ptm180 -73.69 -20.82 60.43 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 119.365 -0.35 . . . . 0.0 111.809 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -95.16 -33.3 12.68 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 122.998 0.519 . . . . 0.0 111.67 -177.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 28.0 t0 74.59 42.72 0.28 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 128.269 2.628 . . . . 0.0 113.777 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 25.6 p-10 -100.65 9.98 41.77 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.316 1.046 . . . . 0.0 112.174 169.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 76.44 -3.71 2.49 Favored 'General case' 0 C--N 1.334 -0.087 0 C-N-CA 126.539 1.935 . . . . 0.0 113.945 -173.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -98.68 121.66 40.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.2 mm -90.68 110.7 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 106.155 -1.794 . . . . 0.0 106.155 172.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -86.73 172.62 10.03 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.745 0.818 . . . . 0.0 109.916 174.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -56.08 -47.25 78.35 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 118.926 -0.559 . . . . 0.0 111.726 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -55.47 -55.44 31.78 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 119.041 0.837 . . . . 0.0 111.17 178.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -55.17 -45.84 75.74 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.769 0.827 . . . . 0.0 110.331 -179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -65.97 -51.52 57.66 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.49 -177.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.3 mt -48.07 -55.23 2.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.87 0.868 . . . . 0.0 109.432 173.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -49.09 -58.28 5.22 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.143 0.977 . . . . 0.0 111.179 177.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.0 tt -67.97 -36.31 75.12 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 119.535 1.061 . . . . 0.0 111.981 -175.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.442 ' CE ' HD13 ' A' ' 168' ' ' LEU . 11.2 mmt -59.95 -41.99 93.07 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 121.726 -0.609 . . . . 0.0 110.64 178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -66.18 -56.5 11.05 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.401 -0.222 . . . . 0.0 110.401 172.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -41.37 -50.01 3.79 Favored 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.235 1.414 . . . . 0.0 111.408 -179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.1 m -85.39 -0.57 55.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.724 0.81 . . . . 0.0 112.297 -171.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.02 36.93 28.42 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.265 -0.897 . . . . 0.0 111.202 -170.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.3 -40.74 23.19 Favored 'General case' 0 N--CA 1.457 -0.095 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 169.877 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 . . . . . 0 C--O 1.25 1.131 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 169.014 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.2 pttp . . . . . 0 N--CA 1.476 0.842 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -76.83 62.85 2.12 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.257 1.023 . . . . 0.0 109.788 -175.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.68 64.5 6.42 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.084 0.954 . . . . 0.0 110.852 -173.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -103.56 -89.17 0.4 Allowed 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 169.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 81.2 mt -125.08 174.6 7.93 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 107.731 -1.211 . . . . 0.0 107.731 169.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.65 -45.63 84.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 -177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -46.53 -42.54 15.89 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.636 0.774 . . . . 0.0 111.413 173.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 1.6 m -53.77 -26.71 24.99 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.705 1.202 . . . . 0.0 112.618 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 58.4 mttm -82.15 -56.3 4.02 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 123.357 0.663 . . . . 0.0 109.895 -175.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 37.8 m95 -52.22 -46.02 65.51 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 171.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -46.06 -64.57 0.71 Allowed 'General case' 0 N--CA 1.455 -0.185 0 C-N-CA 125.115 1.366 . . . . 0.0 109.953 170.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 40.1 ttt85 -58.76 -39.83 82.13 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -176.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.5 mt -56.07 -47.28 78.26 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 118.999 0.818 . . . . 0.0 111.168 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -75.61 -57.93 3.59 Favored 'General case' 0 C--N 1.335 -0.04 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 174.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 2.7 m-30 -75.66 36.14 0.13 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.015 0.926 . . . . 0.0 111.933 -171.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 20.6 t-80 -73.44 -4.1 31.59 Favored 'General case' 0 CA--C 1.531 0.228 0 O-C-N 121.099 -1.0 . . . . 0.0 111.764 -171.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -44.33 -36.36 2.77 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 125.748 1.619 . . . . 0.0 110.359 169.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -69.17 72.8 0.29 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 122.856 0.462 . . . . 0.0 110.138 170.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.211 0 C-N-CA 126.26 1.824 . . . . 0.0 111.04 174.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 110.497 -1.041 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.2 m -71.28 65.5 0.41 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 125.089 1.356 . . . . 0.0 110.61 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -29.01 -66.62 0.09 OUTLIER Glycine 0 CA--C 1.529 0.932 0 C-N-CA 126.873 2.177 . . . . 0.0 114.811 -169.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 33.7 mp0 -59.32 -50.88 72.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.402 0.681 . . . . 0.0 110.788 -175.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 43.7 ttp180 -57.59 -50.9 71.59 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.364 0.666 . . . . 0.0 109.419 -179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 75.4 m-20 -58.79 -48.48 81.11 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.201 0.601 . . . . 0.0 109.632 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 38.9 m -54.86 -50.96 67.39 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 122.402 0.281 . . . . 0.0 110.37 176.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 21.6 ttp85 -57.76 -41.85 82.79 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.018 0.127 . . . . 0.0 110.743 178.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -59.49 -50.11 75.17 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.684 0.394 . . . . 0.0 110.228 177.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -63.25 -43.77 97.06 Favored 'General case' 0 CA--C 1.531 0.238 0 O-C-N 122.103 -0.373 . . . . 0.0 110.599 -178.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 54.6 mt -51.43 -49.48 32.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 110.002 -0.369 . . . . 0.0 110.002 169.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.56 -38.96 88.21 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.892 -0.505 . . . . 0.0 110.406 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -54.45 -53.78 49.62 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.752 -0.592 . . . . 0.0 109.827 169.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.3 -46.35 79.82 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 118.024 0.374 . . . . 0.0 111.855 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.97 -51.51 61.26 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.035 0.934 . . . . 0.0 109.951 176.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 30.8 ttp-105 -63.71 -46.5 85.16 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.031 0.532 . . . . 0.0 110.872 -177.501 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -43.26 89.55 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 177.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.3 m-30 -60.28 -50.56 73.14 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-O 118.902 -0.57 . . . . 0.0 110.989 175.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -75.07 59.38 0.94 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.622 0.646 . . . . 0.0 111.95 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -54.19 -41.13 68.23 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.309 1.444 . . . . 0.0 111.577 177.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -64.59 -19.83 65.89 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.566 0.746 . . . . 0.0 111.84 177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.5 46.82 17.27 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 124.733 1.213 . . . . 0.0 109.971 -172.498 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.2 m -69.74 -19.52 63.53 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.836 -0.54 . . . . 0.0 111.379 175.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 101.59 -40.91 2.27 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 108.981 -1.648 . . . . 0.0 108.981 -172.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.9 p -107.19 166.19 10.81 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 126.536 1.935 . . . . 0.0 108.056 169.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.8 mt -86.42 124.5 40.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.419 -2.067 . . . . 0.0 105.419 169.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 58.7 p -112.36 169.34 8.94 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.098 0.559 . . . . 0.0 110.831 -179.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.1 tp -48.86 -40.13 11.96 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 124.193 0.997 . . . . 0.0 111.279 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 52.1 mtmt -54.88 -54.31 44.17 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.368 1.067 . . . . 0.0 109.907 175.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -58.59 -50.79 72.53 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.653 0.781 . . . . 0.0 109.688 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 76.2 mt -56.56 -49.18 75.59 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 -178.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 8.4 tpt180 -58.0 -52.24 66.33 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-O 118.925 -0.559 . . . . 0.0 110.112 177.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -48.88 -58.54 4.68 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.643 0.777 . . . . 0.0 109.984 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.3 t -49.89 -55.79 4.6 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.083 0 C-N-CA 124.138 0.975 . . . . 0.0 109.599 177.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.2 -51.71 68.6 Favored 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 122.318 0.247 . . . . 0.0 111.225 -174.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -62.62 -31.89 72.82 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.644 -0.66 . . . . 0.0 112.346 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 -60.16 -28.71 68.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 119.565 1.075 . . . . 0.0 111.906 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.4 mt -89.98 8.74 30.91 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.354 0.662 . . . . 0.0 111.037 173.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 84.09 -16.98 30.16 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 124.807 1.194 . . . . 0.0 112.284 -175.407 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -76.03 89.26 2.99 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 118.264 1.032 . . . . 0.0 108.368 -171.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -82.87 69.17 9.62 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 -178.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 75.5 mt -67.01 133.78 50.62 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 124.123 0.969 . . . . 0.0 109.492 -175.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 30.0 p -68.61 159.8 31.3 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 121.778 -0.576 . . . . 0.0 110.113 -179.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -52.38 -37.7 57.07 Favored 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 122.548 0.339 . . . . 0.0 110.606 176.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.418 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -61.25 -56.81 16.4 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.033 0.533 . . . . 0.0 110.64 176.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -52.95 -49.99 64.96 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 121.714 0.769 . . . . 0.0 109.944 179.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -58.02 -42.09 84.55 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.84 176.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -63.76 -31.51 72.71 Favored 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 119.207 0.912 . . . . 0.0 112.292 176.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -62.54 -47.54 83.45 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.857 1.208 . . . . 0.0 110.031 171.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.2 mtp -56.22 -51.16 69.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 122.459 0.304 . . . . 0.0 110.635 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.6 mm -49.65 -61.04 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.222 -0.392 0 C-N-CA 123.8 0.84 . . . . 0.0 108.899 175.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.17 -35.24 71.29 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.346 1.059 . . . . 0.0 111.107 -173.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -63.45 -48.85 76.03 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 122.133 -0.354 . . . . 0.0 111.407 174.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.09 -40.88 37.07 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 -173.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -77.28 105.56 8.47 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 126.442 1.897 . . . . 0.0 110.335 -169.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -80.47 -17.02 52.92 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.223 -0.418 . . . . 0.0 112.12 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.0 p30 -96.51 -28.9 14.19 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 118.431 0.56 . . . . 0.0 112.306 -172.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.5 t0 76.02 38.01 0.36 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.414 2.286 . . . . 0.0 113.562 174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.3 p-10 -94.71 -2.09 51.79 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 123.998 0.919 . . . . 0.0 112.522 169.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 71.21 32.82 2.13 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.894 1.278 . . . . 0.0 110.837 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -134.02 145.81 49.8 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.023 1.329 . . . . 0.0 108.266 171.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 7.5 mm -102.74 115.66 45.08 Favored 'Isoleucine or valine' 0 C--O 1.232 0.154 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 171.386 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.6 p30 -88.37 174.02 8.39 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.349 0.66 . . . . 0.0 110.145 173.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -52.51 -54.67 29.55 Favored 'General case' 0 C--O 1.222 -0.357 0 CA-C-O 118.829 -0.605 . . . . 0.0 111.45 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -52.78 -52.74 55.48 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.018 0.826 . . . . 0.0 111.545 -178.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -56.67 -46.86 80.88 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 123.278 0.631 . . . . 0.0 110.484 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 33.8 t80 -62.59 -53.12 59.35 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.184 -0.462 . . . . 0.0 109.957 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.1 mt -47.75 -52.52 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 124.773 1.229 . . . . 0.0 109.852 175.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.09 -56.38 16.64 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 123.676 0.79 . . . . 0.0 111.267 177.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 3.9 tt -68.36 -34.25 64.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-N 119.873 1.215 . . . . 0.0 111.521 -175.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 17.2 mmt -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.453 -0.313 0 O-C-N 122.091 -0.381 . . . . 0.0 110.511 176.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -61.07 -58.69 7.33 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 110.156 -0.313 . . . . 0.0 110.156 171.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 23.9 ttpp -43.16 -52.11 5.67 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.091 1.356 . . . . 0.0 111.268 -176.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.489 ' HB ' HD12 ' A' ' 168' ' ' LEU . 4.1 m -84.8 3.02 39.61 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.181 0.593 . . . . 0.0 112.002 -171.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.8 m 56.73 35.42 26.18 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.282 -0.886 . . . . 0.0 111.551 -171.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.545 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.3 OUTLIER -79.16 -39.49 33.33 Favored 'General case' 0 CA--C 1.527 0.059 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 169.591 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 C--O 1.25 1.124 0 N-CA-C 107.542 -1.281 . . . . 0.0 107.542 169.197 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 61.4 pttt . . . . . 0 N--CA 1.475 0.818 0 CA-C-O 120.541 0.21 . . . . 0.0 110.766 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -84.35 70.22 10.6 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 175.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -42.3 -45.43 4.21 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.109 0.964 . . . . 0.0 111.298 -177.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 51.0 mp0 -44.06 -50.0 8.58 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.917 1.287 . . . . 0.0 111.388 178.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 75.3 mt -69.97 -23.88 63.24 Favored 'General case' 0 CA--C 1.53 0.19 0 C-N-CA 122.971 0.508 . . . . 0.0 111.588 -176.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.3 mm -81.66 -49.09 18.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -49.72 -43.8 47.9 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.485 1.114 . . . . 0.0 110.085 171.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.9 m -50.5 -32.87 19.38 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 175.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 61.9 mttp -73.59 -50.39 21.41 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.872 0.76 . . . . 0.0 110.474 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 45.3 m95 -51.0 -47.03 61.68 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 118.676 0.671 . . . . 0.0 110.04 172.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -50.49 -60.43 3.02 Favored 'General case' 0 C--O 1.233 0.207 0 C-N-CA 123.833 0.853 . . . . 0.0 111.11 171.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -53.83 -52.93 58.79 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 122.919 0.488 . . . . 0.0 110.13 -175.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 20.8 mt -48.93 -48.37 42.77 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 117.814 0.279 . . . . 0.0 111.577 -169.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 4.0 mt -83.61 -55.41 4.3 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-O 119.58 -0.248 . . . . 0.0 110.634 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.545 ' CE1' HD23 ' A' ' 168' ' ' LEU . 7.1 m-30 -60.21 -26.58 66.5 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 118.573 0.624 . . . . 0.0 111.918 -170.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -48.37 -29.04 3.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.0 0.92 . . . . 0.0 112.436 172.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -58.89 -23.09 60.66 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 113.3 0.852 . . . . 0.0 113.3 177.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 51.4 tttp 53.03 40.34 31.01 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.796 1.238 . . . . 0.0 111.072 -176.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? . . . . . 0 C--O 1.252 1.199 0 CA-C-O 117.346 -1.312 . . . . 0.0 110.026 176.071 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 N-CA-C 111.52 -0.632 . . . . 0.0 111.52 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 12.4 p -72.62 171.32 12.69 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.995 0.518 . . . . 0.0 109.895 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.38 -62.67 4.45 Favored Glycine 0 CA--C 1.529 0.934 0 N-CA-C 109.754 -1.338 . . . . 0.0 109.754 169.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -109.04 166.38 10.88 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.623 1.169 . . . . 0.0 109.89 176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.01 70.43 2.02 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 107.467 -1.308 . . . . 0.0 107.467 172.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -39.16 -54.99 1.71 Allowed 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.976 1.711 . . . . 0.0 112.197 -175.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.7 m -50.85 -48.4 60.02 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.672 0.789 . . . . 0.0 111.728 178.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -64.27 -45.38 88.33 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.1 mm-40 -59.9 -43.85 94.61 Favored 'General case' 0 CA--C 1.534 0.365 0 O-C-N 121.945 -0.472 . . . . 0.0 110.958 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -59.71 -50.79 72.47 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 123.416 0.687 . . . . 0.0 109.884 177.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 46.8 mt -49.97 -49.95 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.983 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -66.52 -42.96 86.51 Favored 'General case' 0 N--CA 1.452 -0.344 0 O-C-N 121.862 -0.524 . . . . 0.0 110.347 -173.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -54.35 -50.97 66.21 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 121.721 -0.612 . . . . 0.0 110.294 171.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.42 -40.78 87.78 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.626 0.648 . . . . 0.0 112.427 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -54.0 -50.69 66.04 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 123.512 0.725 . . . . 0.0 109.254 176.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 62.6 mtp180 -66.14 -41.04 90.96 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.976 -0.535 . . . . 0.0 112.084 177.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.91 -49.02 72.3 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 119.024 0.829 . . . . 0.0 109.234 177.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.52 -53.04 58.2 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 119.215 -0.421 . . . . 0.0 110.673 176.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -73.34 58.4 0.54 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.513 0.725 . . . . 0.0 110.584 177.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 9.6 t0 -59.26 -37.26 77.16 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 124.32 1.048 . . . . 0.0 109.797 178.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -60.18 -20.85 60.49 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 122.867 0.467 . . . . 0.0 111.524 175.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.6 49.78 12.04 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 126.045 1.738 . . . . 0.0 110.671 -179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 47.8 p -76.14 -28.24 57.34 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 122.05 -0.407 . . . . 0.0 111.084 175.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 107.24 -10.21 39.53 Favored Glycine 0 CA--C 1.533 1.169 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 -168.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 46.7 p -133.88 154.73 50.85 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.74 1.616 . . . . 0.0 107.942 176.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 21.0 mt -84.86 114.78 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 170.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.3 p -97.3 166.44 11.55 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.12 0.873 . . . . 0.0 111.628 -177.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.8 tp -47.57 -41.78 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.827 0.851 . . . . 0.0 110.785 169.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -61.2 -50.92 71.16 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.147 0.579 . . . . 0.0 110.205 178.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -54.96 -51.32 66.52 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 122.919 0.488 . . . . 0.0 110.063 178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.0 mt -57.85 -53.51 57.36 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 110.072 -0.344 . . . . 0.0 110.072 -178.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -55.51 -50.83 68.92 Favored 'General case' 0 C--N 1.34 0.163 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -49.78 -59.28 3.97 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.237 1.015 . . . . 0.0 110.597 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 74.4 t -57.74 -46.89 86.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 O-C-N 122.156 -0.34 . . . . 0.0 110.689 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.86 -54.29 48.74 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 121.816 -0.552 . . . . 0.0 111.266 -176.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.41 -37.14 82.38 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.784 -0.573 . . . . 0.0 111.298 178.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -61.46 -43.27 99.17 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.57 0.623 . . . . 0.0 111.381 174.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 20.1 mt -65.58 -25.92 67.63 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.316 0.507 . . . . 0.0 110.722 172.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 101.02 -0.3 54.93 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 125.356 1.455 . . . . 0.0 111.559 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -77.15 90.27 3.66 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 170.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -79.1 69.95 5.37 Favored 'General case' 0 CA--C 1.533 0.306 0 O-C-N 121.785 -0.572 . . . . 0.0 110.204 -176.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 72.3 mt -70.82 144.03 50.91 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.107 0.563 . . . . 0.0 110.637 -173.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 21.1 p -77.72 161.53 27.67 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 122.839 0.455 . . . . 0.0 110.241 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -51.94 -45.62 64.4 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 173.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.433 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.3 mp0 -57.65 -55.57 33.18 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.947 0.499 . . . . 0.0 110.317 179.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -52.79 -50.67 63.13 Favored 'General case' 0 C--N 1.34 0.193 0 CA-C-O 120.942 0.401 . . . . 0.0 110.286 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.3 mt -57.74 -44.24 85.94 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.776 -0.37 . . . . 0.0 111.013 176.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -62.05 -29.86 70.58 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.441 -0.787 . . . . 0.0 112.117 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 62.0 mt-10 -61.48 -49.82 75.22 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.939 1.245 . . . . 0.0 110.145 169.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.0 mtp -56.45 -52.16 65.72 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.756 0.422 . . . . 0.0 110.145 179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.99 -64.27 0.27 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.56 -36.41 69.27 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.025 0.93 . . . . 0.0 112.039 -172.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -57.97 -38.76 76.62 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.67 0.388 . . . . 0.0 111.286 176.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.96 -44.16 7.48 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.395 0.887 . . . . 0.0 113.395 -177.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -74.26 104.19 4.94 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.935 1.694 . . . . 0.0 110.385 -169.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 25.7 ptt-85 -91.58 -11.69 36.49 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 122.86 0.464 . . . . 0.0 111.553 174.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -95.82 -20.58 18.71 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.918 0.487 . . . . 0.0 112.274 -169.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 75.91 33.14 0.62 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.611 1.964 . . . . 0.0 112.902 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 -84.54 -13.73 50.96 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.762 0.825 . . . . 0.0 111.788 169.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 65.29 39.0 5.55 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.913 1.285 . . . . 0.0 110.183 -171.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 14.6 mt-10 -139.62 168.86 18.87 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 126.575 1.95 . . . . 0.0 106.84 170.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -106.94 125.56 62.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 N-CA-C 107.112 -1.44 . . . . 0.0 107.112 170.323 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -89.99 172.21 9.02 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 169.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -52.4 -57.24 10.44 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-O 119.371 -0.347 . . . . 0.0 111.811 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -46.91 87.75 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 118.367 0.531 . . . . 0.0 110.917 -172.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -54.87 -48.22 73.23 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 123.44 0.696 . . . . 0.0 110.185 176.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -60.77 -57.13 13.97 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 -179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -42.99 -55.48 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 124.724 1.21 . . . . 0.0 110.356 174.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 57.1 mtp180 -54.02 -54.82 33.87 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 123.114 0.565 . . . . 0.0 111.044 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 12.1 tt -66.59 -33.54 64.15 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 CA-C-N 119.188 0.904 . . . . 0.0 112.727 -178.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.423 ' CE ' HD13 ' A' ' 168' ' ' LEU . 2.9 mmm -61.93 -39.93 93.76 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 177.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -63.79 -55.23 24.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.406 173.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 28.9 mtmm -45.8 -49.63 14.89 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 118.613 0.642 . . . . 0.0 111.209 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.798 ' HB ' HD12 ' A' ' 168' ' ' LEU . 2.6 m -83.95 4.37 30.02 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -171.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.6 m 58.33 31.19 20.58 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 119.562 1.074 . . . . 0.0 112.28 -173.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.798 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.2 OUTLIER -77.39 -41.81 38.68 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.311 0.644 . . . . 0.0 109.941 174.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 117.17 -1.395 . . . . 0.0 109.399 173.511 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -45.41 -40.66 8.36 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.726 1.21 . . . . 0.0 112.457 -176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 17.4 mtp-105 -45.87 -41.91 11.89 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 176.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -59.33 -46.73 87.79 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.369 0.531 . . . . 0.0 110.059 178.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 51.4 mt -63.02 -44.79 94.97 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.033 0.533 . . . . 0.0 109.625 -179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.56 -61.03 1.72 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.272 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -53.97 -38.66 65.25 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.256 1.023 . . . . 0.0 111.16 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 31.9 p -53.48 -33.52 54.59 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-N 118.131 0.423 . . . . 0.0 112.029 179.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -56.72 -38.7 72.69 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 119.269 -0.395 . . . . 0.0 110.781 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -62.98 -52.06 64.45 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.278 0.945 . . . . 0.0 110.777 177.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.43 ' HB2' ' CE2' ' B' ' 253' ' ' PHE 0.28 1.7 p-80 -60.89 -47.12 87.84 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.464 -179.608 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.5 ttm180 -49.07 -62.62 1.43 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.056 1.342 . . . . 0.0 109.956 174.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -55.38 -53.8 51.65 Favored 'General case' 0 C--N 1.333 -0.11 0 C-N-CA 125.278 1.431 . . . . 0.0 110.167 -174.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.57 HD13 HD22 ' A' ' 168' ' ' LEU . 1.3 tt -67.8 -56.99 7.08 Favored 'General case' 0 N--CA 1.457 -0.115 0 O-C-N 121.977 -0.452 . . . . 0.0 110.452 -175.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.43 ' CE2' ' HB2' ' B' ' 249' ' ' HIS . 10.7 m-30 -60.9 -30.5 70.21 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 122.543 0.337 . . . . 0.0 111.225 -173.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -58.68 -29.75 66.85 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.547 0.612 . . . . 0.0 111.582 173.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -75.15 67.23 1.78 Allowed 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 119.327 0.967 . . . . 0.0 110.05 176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 26.2 mtpp -73.62 73.44 1.48 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.13 0.972 . . . . 0.0 109.856 -179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 93.0 mttt . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.207 -1.378 . . . . 0.0 110.946 175.278 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.15 0 N-CA-C 111.455 -0.658 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.4 m 69.91 -60.43 0.48 Allowed 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.76 1.624 . . . . 0.0 110.398 -173.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.02 67.29 1.75 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 108.745 -1.742 . . . . 0.0 108.745 169.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -67.54 93.94 0.38 Allowed 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.191 0.596 . . . . 0.0 109.604 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.9 mmm180 -72.29 61.19 0.46 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.128 0.971 . . . . 0.0 111.574 179.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -115.14 -75.52 0.59 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.204 1.402 . . . . 0.0 108.75 176.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.9 m 51.37 26.07 2.91 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.667 1.187 . . . . 0.0 112.841 -179.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 27.4 ttp-105 -56.77 -50.27 72.8 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 124.182 0.993 . . . . 0.0 110.717 -169.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 57.7 mp0 -57.21 -50.18 73.66 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.392 0.677 . . . . 0.0 110.099 -178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -67.48 -43.36 81.18 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 122.444 0.297 . . . . 0.0 110.482 -174.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 67.9 mt -51.62 -51.78 24.56 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 169.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.96 -42.16 94.83 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.854 -0.528 . . . . 0.0 110.804 -173.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -52.94 -51.92 59.72 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.756 -0.59 . . . . 0.0 110.192 170.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -59.99 -40.28 88.63 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.947 -0.471 . . . . 0.0 112.038 178.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -54.27 -51.91 63.08 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.727 -0.608 . . . . 0.0 109.732 174.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 81.0 mtp180 -58.36 -48.11 81.64 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.131 177.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.36 -45.13 76.52 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.389 0.54 . . . . 0.0 110.003 178.53 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.469 ' CE2' HD21 ' B' ' 252' ' ' LEU . 14.0 m-85 -62.81 -43.84 97.75 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 119.1 -0.476 . . . . 0.0 111.778 177.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 55.7 t0 -75.67 62.55 1.49 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.118 0.485 . . . . 0.0 111.094 -177.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -51.72 -40.69 60.62 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.598 1.559 . . . . 0.0 111.493 179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -81.92 4.36 22.84 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.603 0.761 . . . . 0.0 112.603 -178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 46.15 42.28 9.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.718 1.607 . . . . 0.0 113.445 177.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 40.2 p -76.21 -41.66 48.7 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 123.401 0.681 . . . . 0.0 111.388 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 117.59 -15.86 12.7 Favored Glycine 0 CA--C 1.534 1.222 0 C-N-CA 126.211 1.862 . . . . 0.0 109.956 -169.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.2 p -147.59 126.38 12.66 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 -176.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.2 mt -77.45 114.35 17.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 CA-C-N 118.601 0.637 . . . . 0.0 110.249 -168.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 36.5 p -90.21 171.48 9.47 Favored 'General case' 0 N--CA 1.463 0.176 0 O-C-N 120.974 -1.079 . . . . 0.0 112.197 -177.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -50.93 -36.78 15.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 122.258 -0.276 . . . . 0.0 111.223 169.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -64.28 -48.38 75.92 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.964 -0.46 . . . . 0.0 110.059 177.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -56.38 -49.66 73.81 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 121.319 0.581 . . . . 0.0 109.668 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 94.5 mt -57.28 -51.22 70.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 118.975 -0.536 . . . . 0.0 110.455 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 12.6 tpt180 -59.26 -47.57 84.86 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-O 118.545 -0.741 . . . . 0.0 110.612 178.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -49.01 -60.43 2.78 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.801 0.728 . . . . 0.0 110.092 178.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 77.1 t -60.14 -48.98 85.88 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.145 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.853 -178.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.0 -53.01 62.1 Favored 'General case' 0 N--CA 1.452 -0.363 0 O-C-N 121.99 -0.444 . . . . 0.0 110.172 -177.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 7.4 tmtm? -54.58 -49.29 70.75 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.971 0.908 . . . . 0.0 109.819 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 79.2 mt-10 -56.62 -42.11 78.25 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 118.432 0.56 . . . . 0.0 112.364 176.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 72.5 mt -63.59 -24.5 67.83 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.398 0.545 . . . . 0.0 111.43 173.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 115.08 -21.42 13.34 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 125.817 1.675 . . . . 0.0 110.601 -175.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.7 mm-40 -72.39 90.38 1.29 Allowed 'General case' 0 N--CA 1.445 -0.677 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 -176.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -76.77 70.15 3.21 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 94.0 mt -71.43 132.38 44.7 Favored 'General case' 0 N--CA 1.456 -0.145 0 C-N-CA 122.796 0.438 . . . . 0.0 110.066 -172.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 65.5 p -67.84 158.99 31.29 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 123.566 0.746 . . . . 0.0 109.736 -179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.4 tt0 -48.04 -43.82 30.64 Favored 'General case' 0 C--O 1.224 -0.237 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 171.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.1 mp0 -60.91 -56.92 15.47 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.001 0.52 . . . . 0.0 110.525 -179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -52.81 -47.99 67.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 118.592 0.633 . . . . 0.0 111.12 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 43.6 mt -56.83 -48.03 78.96 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.95 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -64.77 -30.89 71.91 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-O 118.926 -0.559 . . . . 0.0 112.469 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.0 -52.59 64.35 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 119.103 0.865 . . . . 0.0 109.397 170.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 15.2 mtm -54.61 -51.61 64.81 Favored 'General case' 0 C--O 1.232 0.145 0 O-C-N 122.353 -0.217 . . . . 0.0 111.288 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.7 mm -51.27 -57.4 3.1 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -62.16 -36.54 82.14 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.254 0.622 . . . . 0.0 111.627 -172.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.0 tp10 -65.38 -54.49 28.04 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 121.837 -0.539 . . . . 0.0 110.896 173.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -73.91 -36.89 64.76 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -169.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -84.83 112.9 20.95 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 125.994 1.718 . . . . 0.0 111.757 -169.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.56 -11.62 23.49 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.134 0.974 . . . . 0.0 111.552 169.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -87.02 -15.17 39.46 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.26 1.024 . . . . 0.0 112.054 -178.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.1 p30 59.26 15.13 4.04 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 127.824 2.45 . . . . 0.0 115.454 175.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -94.56 2.03 55.66 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 123.813 0.845 . . . . 0.0 112.042 175.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.253 0.0 OUTLIER 83.7 -15.35 0.62 Allowed 'General case' 0 N--CA 1.463 0.19 0 C-N-CA 127.647 2.379 . . . . 0.0 113.059 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -97.82 121.56 39.88 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 -171.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.4 mm -78.58 110.67 14.56 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.446 0 N-CA-C 105.831 -1.915 . . . . 0.0 105.831 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -82.48 168.45 17.42 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 121.417 0.627 . . . . 0.0 110.002 176.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -55.24 -48.27 74.2 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.641 -175.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -56.76 -51.35 69.24 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.85 0.86 . . . . 0.0 110.694 -178.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -56.77 -46.87 81.21 Favored 'General case' 0 C--O 1.231 0.087 0 C-N-CA 123.277 0.631 . . . . 0.0 110.603 177.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -62.3 -49.92 73.73 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.094 -177.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.8 mt -49.49 -54.33 6.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.179 0.992 . . . . 0.0 109.808 172.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 4.5 tmm_? -50.96 -57.22 9.12 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.378 0.671 . . . . 0.0 110.274 -179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 11.2 tt -65.64 -40.76 88.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.395 -175.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.505 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.1 OUTLIER -54.27 -43.14 70.73 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 121.644 -0.66 . . . . 0.0 112.281 175.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -67.43 -58.32 4.96 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 117.902 0.319 . . . . 0.0 110.845 172.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -43.06 -57.38 2.92 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 125.081 1.352 . . . . 0.0 111.179 -177.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.409 HG22 ' CE1' ' B' ' 249' ' ' HIS . 10.3 m -82.66 8.48 11.89 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 124.445 1.098 . . . . 0.0 111.381 -171.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 19.6 m 52.36 37.21 21.88 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 121.264 -0.898 . . . . 0.0 111.259 -176.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.707 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -81.44 -32.63 32.54 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.858 0.863 . . . . 0.0 109.627 177.33 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 . . . . . 0 C--O 1.252 1.207 0 CA-C-O 117.379 -1.296 . . . . 0.0 108.866 168.764 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.5 mttm . . . . . 0 N--CA 1.475 0.792 0 N-CA-C 110.402 -0.221 . . . . 0.0 110.402 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -75.39 69.52 2.19 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 176.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -54.73 -24.85 24.06 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.262 1.025 . . . . 0.0 112.746 -173.294 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -44.38 -41.76 6.39 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.23 1.012 . . . . 0.0 111.729 170.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.78 -34.2 71.18 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 122.677 0.391 . . . . 0.0 111.062 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 11.2 mt -75.5 -49.08 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.67 -43.29 57.42 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.735 0.414 . . . . 0.0 110.139 177.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 45.4 m -48.91 -35.76 15.68 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.636 1.174 . . . . 0.0 112.85 175.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.3 mmpt? -66.38 -61.35 2.05 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 109.592 -0.522 . . . . 0.0 109.592 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 61.8 m95 -55.91 -41.9 75.23 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.246 0.618 . . . . 0.0 110.603 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.409 ' CE1' HG22 ' A' ' 166' ' ' THR . 56.1 m-70 -51.49 -64.6 0.76 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.212 0.605 . . . . 0.0 110.378 172.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 35.9 ttt85 -57.26 -42.62 81.91 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-O 119.618 -0.229 . . . . 0.0 110.981 -175.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -46.51 -63.92 0.89 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 124.24 1.016 . . . . 0.0 111.908 176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.548 HD12 HD22 ' A' ' 168' ' ' LEU . 67.0 mt -81.63 -38.76 25.49 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 120.612 -0.435 . . . . 0.0 112.13 -174.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.707 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.5 m-30 -71.8 -43.19 66.08 Favored 'General case' 0 C--N 1.333 -0.109 0 O-C-N 121.804 -0.56 . . . . 0.0 110.042 -176.256 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER 33.44 -112.98 0.05 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.092 1.757 . . . . 0.0 113.615 -179.48 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -70.3 -57.03 5.32 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -154.03 154.04 33.0 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 106.068 -1.827 . . . . 0.0 106.068 169.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 26.1 ttpp . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.186 -1.388 . . . . 0.0 109.918 -179.767 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.269 -0.732 . . . . 0.0 111.269 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.8 m -72.89 58.88 0.48 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.297 1.439 . . . . 0.0 111.92 -176.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -81.03 57.61 4.84 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 123.956 0.789 . . . . 0.0 111.599 -175.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.82 70.36 2.57 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 173.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -72.92 67.63 0.85 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 126.725 2.01 . . . . 0.0 108.488 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -158.52 -163.79 1.34 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.044 0.938 . . . . 0.0 110.388 -169.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 47.2 m -27.82 -42.13 0.02 OUTLIER 'General case' 0 C--N 1.342 0.243 0 C-N-CA 127.827 2.451 . . . . 0.0 115.081 171.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -42.86 -49.84 5.78 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 119.066 0.848 . . . . 0.0 111.011 177.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.36 -45.01 85.85 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 122.748 0.419 . . . . 0.0 110.329 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -64.77 -46.96 79.9 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 122.911 0.484 . . . . 0.0 109.917 -177.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 71.1 mt -51.25 -52.13 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 C-N-CA 124.152 0.981 . . . . 0.0 109.189 171.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.82 -41.98 91.15 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 122.006 -0.434 . . . . 0.0 110.696 -173.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -56.81 -51.49 68.75 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.581 -0.699 . . . . 0.0 110.849 171.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.06 -45.1 79.39 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 118.257 0.481 . . . . 0.0 111.542 178.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -51.71 -52.89 44.95 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.169 0.988 . . . . 0.0 109.733 176.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 40.9 mtp85 -63.18 -46.43 87.13 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 119.05 -0.5 . . . . 0.0 112.114 178.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.53 -43.95 80.35 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-N 118.696 0.68 . . . . 0.0 109.632 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -62.94 -51.07 68.32 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 119.043 -0.503 . . . . 0.0 110.839 174.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -73.41 62.13 0.71 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.653 0.781 . . . . 0.0 111.354 -178.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -49.92 -42.6 48.55 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.572 1.549 . . . . 0.0 111.157 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -59.79 -25.33 64.84 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.068 0.547 . . . . 0.0 112.183 178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 56.51 43.3 26.08 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.727 1.211 . . . . 0.0 109.601 -170.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -69.08 -19.48 64.07 Favored 'General case' 0 N--CA 1.453 -0.297 0 O-C-N 121.801 -0.562 . . . . 0.0 111.154 174.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.46 -31.88 7.81 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 -172.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 30.0 p -113.75 153.39 29.11 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 127.039 2.136 . . . . 0.0 107.164 169.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.5 mt -80.5 147.92 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 169.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 33.7 p -129.36 165.34 21.7 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.31 0.959 . . . . 0.0 110.91 176.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.2 -42.39 1.96 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 125.183 1.393 . . . . 0.0 111.699 175.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -62.19 -48.73 78.75 Favored 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 123.442 0.697 . . . . 0.0 110.656 178.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -57.69 -49.82 75.26 Favored 'General case' 0 CA--C 1.527 0.082 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 91.5 mt -56.87 -49.58 75.06 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.209 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 14.5 tpt180 -59.31 -42.84 92.31 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.416 176.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -53.42 -58.67 6.28 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.657 1.117 . . . . 0.0 110.012 176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 81.0 t -51.11 -55.3 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 CA-C-O 121.332 0.586 . . . . 0.0 109.661 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.67 -50.42 72.17 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.713 -176.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -56.7 -47.93 78.83 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 125.264 1.425 . . . . 0.0 110.663 178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -57.55 -44.14 84.97 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.794 0.438 . . . . 0.0 110.772 176.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -66.97 -25.45 66.33 Favored 'General case' 0 CA--C 1.533 0.317 0 O-C-N 122.016 -0.428 . . . . 0.0 111.508 174.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 124.36 -28.38 5.31 Favored Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.827 1.68 . . . . 0.0 111.052 178.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -66.22 91.28 0.16 Allowed 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.713 1.205 . . . . 0.0 109.647 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -78.83 69.79 5.06 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 95.3 mt -66.5 142.65 57.46 Favored 'General case' 0 N--CA 1.457 -0.119 0 C-N-CA 123.214 0.605 . . . . 0.0 111.233 -172.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 54.4 p -71.07 155.05 41.25 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 121.088 0.471 . . . . 0.0 109.829 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -50.24 -38.81 42.45 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.417 0.687 . . . . 0.0 109.862 171.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -62.3 -56.9 13.96 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.152 0.581 . . . . 0.0 110.985 177.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -52.11 -49.15 64.18 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 121.675 0.75 . . . . 0.0 110.164 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 41.9 mt -57.88 -44.32 86.61 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.611 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -63.96 -35.14 79.71 Favored 'General case' 0 C--O 1.226 -0.165 0 O-C-N 121.156 -0.965 . . . . 0.0 112.536 175.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -61.47 -45.73 93.03 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 119.411 1.005 . . . . 0.0 109.797 173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 61.9 mtp -58.29 -52.14 66.83 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 122.68 0.392 . . . . 0.0 111.173 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.5 mm -49.68 -58.17 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.341 0.202 0 C-N-CA 124.138 0.975 . . . . 0.0 108.794 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -58.43 -46.66 86.06 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 124.145 0.978 . . . . 0.0 110.534 -172.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.36 -38.96 72.12 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.687 -0.633 . . . . 0.0 111.299 175.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -78.86 -27.71 44.13 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 112.973 0.731 . . . . 0.0 112.973 -179.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -60.54 155.66 18.09 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -168.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -135.89 44.79 2.45 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 127.578 2.351 . . . . 0.0 107.182 169.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.4 p30 165.51 -49.72 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 127.107 2.163 . . . . 0.0 110.039 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 39.8 t0 74.45 59.39 0.08 Allowed 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 126.598 1.959 . . . . 0.0 111.271 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 49.9 p-10 -80.67 5.75 14.73 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.946 1.298 . . . . 0.0 111.43 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.29 34.32 15.97 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.734 1.613 . . . . 0.0 111.808 -171.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -137.87 173.72 11.34 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.555 1.542 . . . . 0.0 107.771 172.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -124.0 117.0 49.59 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 N-CA-C 106.435 -1.691 . . . . 0.0 106.435 169.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -88.04 173.85 8.62 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 170.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -51.49 -50.0 60.73 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.609 176.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -58.49 -54.35 48.03 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.07 0.85 . . . . 0.0 111.583 -177.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -50.36 -47.33 56.16 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.463 0.705 . . . . 0.0 110.712 176.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -64.81 -54.14 35.89 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.542 -0.299 . . . . 0.0 110.568 -177.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 47.7 mt -46.93 -53.53 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 124.515 1.126 . . . . 0.0 109.885 174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.8 -58.33 5.58 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.439 1.096 . . . . 0.0 110.44 178.157 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.5 tt -67.6 -36.49 76.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.777 -0.769 . . . . 0.0 112.198 -175.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 22.1 mmt -58.01 -43.42 86.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 122.765 0.426 . . . . 0.0 110.587 178.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.05 -56.97 9.97 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 171.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -47.41 -37.18 10.96 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.833 1.253 . . . . 0.0 112.277 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 5.1 m -102.13 9.78 39.94 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.688 0.795 . . . . 0.0 111.905 -172.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.5 m 55.39 30.27 14.63 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.353 -0.842 . . . . 0.0 111.857 -176.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -79.12 -33.83 43.96 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.414 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 C--O 1.254 1.324 0 CA-C-O 117.048 -1.453 . . . . 0.0 109.844 169.248 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? . . . . . 0 N--CA 1.473 0.714 0 CA-C-O 120.63 0.252 . . . . 0.0 111.14 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 66.9 mttm 74.54 -40.64 0.45 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.721 2.008 . . . . 0.0 113.094 172.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 19.9 mtm180 -96.4 26.93 4.04 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.166 0.986 . . . . 0.0 111.102 -174.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -39.45 -49.52 2.07 Favored 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 125.561 1.545 . . . . 0.0 112.855 -169.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -45.69 -58.62 3.31 Favored 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 125.012 1.325 . . . . 0.0 111.143 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 74.0 mt -79.51 -48.77 20.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 -174.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -43.03 -44.46 4.76 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.882 1.673 . . . . 0.0 111.364 177.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 82.6 p -48.12 -36.46 13.38 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.194 0.597 . . . . 0.0 112.49 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -73.11 -59.4 2.73 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 121.924 -0.485 . . . . 0.0 109.855 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 7.2 m95 -50.89 -44.19 59.8 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.449 0.568 . . . . 0.0 111.153 177.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -49.14 -66.7 0.35 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 124.439 1.096 . . . . 0.0 109.047 169.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -57.51 -35.47 70.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -174.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.77 -31.17 68.12 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.296 0.953 . . . . 0.0 111.808 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -104.13 -56.06 2.26 Favored 'General case' 0 N--CA 1.462 0.136 0 C-N-CA 123.45 0.7 . . . . 0.0 110.518 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.703 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.2 p90 -113.87 86.09 2.34 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.046 0.939 . . . . 0.0 109.759 177.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -78.22 -41.66 33.69 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 123.551 0.741 . . . . 0.0 109.632 171.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -175.56 -124.06 0.0 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 104.249 -2.501 . . . . 0.0 104.249 177.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -65.52 -38.98 91.26 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 106.624 -1.621 . . . . 0.0 106.624 168.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.874 -1.536 . . . . 0.0 109.697 169.65 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.224 0 N-CA-C 111.502 -0.639 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.7 p -71.08 -72.92 0.19 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 73.12 -172.11 50.19 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.673 -0.971 . . . . 0.0 110.673 -173.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.94 71.46 1.55 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.161 0.584 . . . . 0.0 111.213 -176.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -75.93 55.82 0.93 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.651 0.781 . . . . 0.0 111.046 175.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -151.36 -68.39 0.18 Allowed 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 127.834 2.454 . . . . 0.0 104.834 172.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -47.03 -48.53 22.09 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 124.335 1.054 . . . . 0.0 110.74 169.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 76.3 ttt180 -57.19 -38.92 74.38 Favored 'General case' 0 C--N 1.341 0.196 0 C-N-CA 122.192 0.197 . . . . 0.0 111.472 176.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -64.64 -45.81 85.18 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -64.47 -43.41 94.28 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-O 120.801 0.334 . . . . 0.0 110.545 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 66.2 mt -51.09 -51.28 22.41 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 169.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 104' ' ' LEU . 0.6 OUTLIER -65.77 -34.96 79.38 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.786 -0.571 . . . . 0.0 110.742 -174.949 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -58.14 -53.48 57.74 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.195 -0.94 . . . . 0.0 110.342 170.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -43.22 82.78 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.087 -0.383 . . . . 0.0 111.254 178.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -53.19 -54.89 29.35 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.459 0.704 . . . . 0.0 109.681 175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 80.6 mtm180 -56.31 -48.93 75.68 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-O 119.276 -0.393 . . . . 0.0 111.39 178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.02 -44.48 87.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.218 0.463 . . . . 0.0 110.252 -178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -68.34 -46.83 69.1 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 118.952 -0.547 . . . . 0.0 112.284 178.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -73.91 66.46 1.16 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 118.818 0.736 . . . . 0.0 111.895 -169.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -54.76 -45.38 74.19 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.894 0.878 . . . . 0.0 111.04 177.611 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -60.02 -16.26 29.46 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 176.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 7.4 p30 48.68 31.62 3.12 Favored 'General case' 0 C--N 1.341 0.217 0 C-N-CA 126.49 1.916 . . . . 0.0 113.8 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 89.2 p -71.7 -26.75 62.63 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 122.886 0.475 . . . . 0.0 111.703 176.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.79 3.03 43.01 Favored Glycine 0 CA--C 1.534 1.251 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 -168.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 58.5 p -134.15 133.89 41.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.569 -1.641 . . . . 0.0 106.569 169.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.1 mt -78.34 141.24 15.73 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.134 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 64.3 p -124.29 162.47 23.67 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 118.92 0.782 . . . . 0.0 111.4 179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 5.0 tt -48.71 -37.87 9.18 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 C-N-CA 124.939 1.296 . . . . 0.0 112.174 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -58.74 -49.37 77.88 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 124.111 0.964 . . . . 0.0 110.512 176.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -56.49 -51.44 68.49 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.53 -43.74 84.56 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.644 -176.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.9 tpt85 -57.58 -49.55 76.03 Favored 'General case' 0 N--CA 1.457 -0.076 0 CA-C-O 119.042 -0.504 . . . . 0.0 110.708 175.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.6 mmm180 -57.33 -55.39 35.44 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 118.353 0.524 . . . . 0.0 110.692 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -47.45 -52.22 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.2 0 C-N-CA 124.414 1.086 . . . . 0.0 109.92 178.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.19 78.47 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.23 -0.293 . . . . 0.0 110.605 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -50.65 -45.43 57.88 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.628 1.171 . . . . 0.0 111.777 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 66.6 mm-40 -58.27 -29.96 66.21 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 118.095 0.407 . . . . 0.0 111.935 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 24.7 mt -91.18 15.94 10.83 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.441 0.696 . . . . 0.0 110.554 176.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 78.79 -32.39 1.93 Allowed Glycine 0 CA--C 1.53 0.975 0 C-N-CA 124.744 1.164 . . . . 0.0 112.371 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -62.86 90.82 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.125 0.97 . . . . 0.0 110.372 179.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -76.53 72.78 3.24 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 173.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 89.4 mt -63.88 140.89 58.92 Favored 'General case' 0 N--CA 1.457 -0.104 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 -176.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 82.1 p -67.77 151.14 47.7 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 179.118 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 23.3 mp0 -49.66 -40.56 40.17 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.108 0.563 . . . . 0.0 109.501 172.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -57.74 -56.15 25.72 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.536 0.735 . . . . 0.0 111.565 176.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -52.79 -48.26 67.0 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 120.998 0.427 . . . . 0.0 110.575 177.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.69 -40.51 88.12 Favored 'General case' 0 N--CA 1.454 -0.234 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.758 177.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.28 -42.69 95.99 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 121.823 -0.548 . . . . 0.0 110.091 177.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -59.48 -48.16 82.73 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 122.063 -0.398 . . . . 0.0 110.351 175.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 75.7 mtp -54.62 -48.83 71.75 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.074 0.549 . . . . 0.0 111.086 176.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -55.26 -59.66 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.356 0 C-N-CA 123.345 0.658 . . . . 0.0 109.279 175.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -51.0 -43.8 60.87 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.007 1.323 . . . . 0.0 111.453 -176.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.29 -45.43 80.2 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 122.36 0.264 . . . . 0.0 111.075 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -79.4 -38.79 34.03 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 112.881 0.697 . . . . 0.0 112.881 -175.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -58.65 140.21 54.87 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.823 2.049 . . . . 0.0 108.973 -175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -121.32 51.61 1.28 Allowed 'General case' 0 C--N 1.34 0.16 0 CA-C-O 121.924 0.868 . . . . 0.0 110.688 175.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.5 p30 175.62 -109.99 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 126.292 1.837 . . . . 0.0 106.161 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -172.64 27.05 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.543 1.537 . . . . 0.0 110.819 -175.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 45.7 p-10 -70.44 -18.99 63.0 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.836 -0.54 . . . . 0.0 111.209 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.5 OUTLIER 53.0 39.79 30.06 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.992 1.717 . . . . 0.0 112.644 -170.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -129.84 174.91 9.28 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.644 1.578 . . . . 0.0 107.256 169.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -119.68 97.9 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.842 -1.54 . . . . 0.0 106.842 170.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -75.13 171.18 14.59 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 171.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -54.67 -49.68 70.04 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 122.293 -0.254 . . . . 0.0 111.356 -176.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -59.36 -50.69 72.98 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.144 -0.348 . . . . 0.0 111.282 -179.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -54.05 -42.67 69.47 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.479 0.711 . . . . 0.0 110.313 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -65.99 -54.36 27.04 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.408 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 53.0 mt -46.15 -56.75 1.09 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 124.066 0.946 . . . . 0.0 109.742 174.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 31.0 ttt180 -45.05 -60.37 2.12 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.882 1.273 . . . . 0.0 109.939 176.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.9 tt -68.0 -35.74 72.97 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.604 -0.838 . . . . 0.0 112.734 -173.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.56 ' CE ' HD13 ' A' ' 168' ' ' LEU . 7.8 mmm -63.6 -35.36 80.26 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 119.871 -0.731 . . . . 0.0 110.282 178.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -69.85 -52.45 24.8 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.135 0.425 . . . . 0.0 111.004 171.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt -41.53 -48.68 3.97 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 125.393 1.477 . . . . 0.0 110.945 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.664 ' HB ' HD12 ' A' ' 168' ' ' LEU . 3.8 m -88.56 0.75 56.02 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -171.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 14.8 m 57.65 37.16 27.31 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.093 -1.005 . . . . 0.0 111.929 -170.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.664 HD12 ' HB ' ' A' ' 166' ' ' THR . 0.3 OUTLIER -82.32 -43.82 16.99 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 169.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 116.775 -1.584 . . . . 0.0 109.381 173.203 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 1.6 tmtp? . . . . . 0 N--CA 1.472 0.673 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -79.69 64.53 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 109.819 -0.438 . . . . 0.0 109.819 179.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 1.6 tpm_? 96.54 103.63 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 128.297 2.639 . . . . 0.0 109.977 -178.255 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.99 -30.36 14.88 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.749 1.22 . . . . 0.0 113.133 -178.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.2 tp -41.74 -43.26 2.84 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.818 1.247 . . . . 0.0 111.339 170.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 73.5 mt -63.81 -57.57 11.14 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.188 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 178.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -51.47 -40.7 60.0 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.487 1.115 . . . . 0.0 110.492 -176.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 19.1 m -48.63 -35.41 13.62 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.394 1.078 . . . . 0.0 112.264 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -68.12 -54.92 14.6 Favored 'General case' 0 N--CA 1.455 -0.201 0 CA-C-N 118.643 0.656 . . . . 0.0 109.972 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 42.6 m95 -52.24 -48.2 65.32 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 119.142 0.883 . . . . 0.0 110.609 176.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -46.4 -56.48 5.82 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.091 0.956 . . . . 0.0 110.047 170.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 71.5 ttt180 -63.28 -45.08 93.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.896 -0.573 . . . . 0.0 111.208 -176.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 28.6 mt -52.74 -41.09 63.68 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 119.169 0.895 . . . . 0.0 111.269 -170.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -81.88 -62.66 1.57 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 110.211 -0.292 . . . . 0.0 110.211 173.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . . . . . . . . . 6.4 m-30 -58.28 -22.62 53.35 Favored 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -168.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -61.42 -35.88 78.78 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.392 1.077 . . . . 0.0 111.222 173.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -81.26 59.89 4.14 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 123.826 0.85 . . . . 0.0 109.612 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -66.86 -36.01 81.35 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 123.176 0.59 . . . . 0.0 111.036 -176.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 23.7 pttm . . . . . 0 C--O 1.253 1.273 0 CA-C-O 116.869 -1.538 . . . . 0.0 109.089 178.549 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.191 0 N-CA-C 111.708 -0.557 . . . . 0.0 111.708 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 2.0 m -75.38 49.7 0.48 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.861 1.264 . . . . 0.0 113.31 -172.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -61.67 153.09 41.21 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 170.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -74.2 70.13 1.6 Allowed 'General case' 0 CA--C 1.528 0.121 0 CA-C-N 117.979 0.89 . . . . 0.0 111.683 -175.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 83.6 mtm-85 -71.08 77.75 0.68 Allowed 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 169.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -32.58 -44.28 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 127.878 2.471 . . . . 0.0 115.116 -170.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 2.6 p -44.3 -47.55 9.51 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.928 0.891 . . . . 0.0 111.182 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -51.97 -52.97 46.74 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.797 1.239 . . . . 0.0 111.111 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mp0 -58.73 -47.01 86.09 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.986 -0.446 . . . . 0.0 110.07 179.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -63.91 -44.72 92.08 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.061 0.392 . . . . 0.0 110.922 -177.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.4 mt -51.08 -51.74 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 C-N-CA 123.512 0.725 . . . . 0.0 109.28 170.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -66.38 -41.75 88.94 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 122.107 -0.371 . . . . 0.0 110.759 -173.223 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -54.65 -53.72 51.0 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.663 -0.648 . . . . 0.0 110.355 171.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.07 -45.07 79.46 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.125 0.421 . . . . 0.0 111.328 177.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.423 ' CD2' HD11 ' A' ' 118' ' ' ILE . 56.9 t80 -51.96 -54.0 34.8 Favored 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 123.463 0.705 . . . . 0.0 110.048 177.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.5 mtp85 -64.39 -43.8 93.32 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 118.981 -0.533 . . . . 0.0 112.11 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.63 -43.46 72.32 Favored 'General case' 0 C--N 1.342 0.272 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.9 m-30 -66.73 -51.24 58.22 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 54.0 t0 -76.21 61.82 1.66 Allowed 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.113 0.565 . . . . 0.0 110.969 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -51.2 -39.81 57.3 Favored 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 124.958 1.303 . . . . 0.0 110.666 174.122 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -57.76 -28.38 63.89 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 123.142 0.577 . . . . 0.0 112.318 178.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.1 t30 56.71 46.77 19.49 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.809 1.244 . . . . 0.0 110.497 -174.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 6.3 p -75.56 -38.53 59.16 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 124.265 1.026 . . . . 0.0 109.77 169.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 106.89 3.36 36.58 Favored Glycine 0 CA--C 1.534 1.279 0 C-N-CA 126.041 1.781 . . . . 0.0 109.086 -168.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 69.1 p -146.32 127.51 14.75 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.914 1.286 . . . . 0.0 108.989 -179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . 0.423 HD11 ' CD2' ' A' ' 107' ' ' PHE . 13.8 mt -77.86 108.15 10.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 O-C-N 120.454 -1.404 . . . . 0.0 107.731 -174.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 60.4 p -79.59 164.94 23.44 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.149 -0.969 . . . . 0.0 111.307 -178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 6.7 tt -54.02 -36.16 30.64 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 O-C-N 121.932 -0.48 . . . . 0.0 110.781 170.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt -63.68 -45.98 87.59 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.167 0.587 . . . . 0.0 110.407 175.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -56.33 -46.93 79.7 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 80.2 mt -59.29 -47.49 85.2 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 122.009 -0.432 . . . . 0.0 111.261 178.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 1.7 tpp180 -58.07 -47.98 81.52 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.926 0.784 . . . . 0.0 110.27 177.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -50.3 -55.29 16.1 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.874 0.87 . . . . 0.0 110.88 175.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 54.4 t -52.22 -52.88 21.64 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.102 0.561 . . . . 0.0 110.381 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.457 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -53.29 -53.75 46.31 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.997 0.919 . . . . 0.0 110.389 -176.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.4 mmtp -54.63 -48.09 72.67 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.026 0.93 . . . . 0.0 110.636 176.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -57.34 -45.12 84.65 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.491 0.587 . . . . 0.0 111.834 176.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 65.6 mt -63.93 -25.81 68.31 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 118.153 0.433 . . . . 0.0 110.857 176.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 108.06 -30.19 9.29 Favored Glycine 0 CA--C 1.526 0.776 0 C-N-CA 125.05 1.31 . . . . 0.0 109.985 -176.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.457 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 68.7 mm-40 -60.0 97.56 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.373 1.069 . . . . 0.0 109.658 177.013 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -73.41 71.09 1.27 Allowed 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.0 mt -62.43 142.97 57.61 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.303 0.641 . . . . 0.0 109.769 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 73.8 p -76.96 145.01 38.4 Favored 'General case' 0 N--CA 1.45 -0.468 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -50.37 -41.36 51.71 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 173.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -54.68 -55.02 34.13 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.275 0.63 . . . . 0.0 111.461 175.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.21 -46.4 79.51 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 118.822 0.737 . . . . 0.0 110.228 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 78.5 mt -57.78 -39.24 77.02 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 120.689 -0.405 . . . . 0.0 111.087 176.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.25 -41.46 96.96 Favored 'General case' 0 N--CA 1.449 -0.487 0 O-C-N 121.885 -0.509 . . . . 0.0 110.059 178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -58.08 -50.47 73.34 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.925 0.784 . . . . 0.0 110.027 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 77.1 mtp -54.46 -47.36 73.0 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.369 0.668 . . . . 0.0 111.017 177.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -56.66 -59.11 3.33 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.42 0 C-N-CA 123.617 0.767 . . . . 0.0 109.423 175.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.38 66.51 Favored 'General case' 0 C--N 1.33 -0.24 0 C-N-CA 124.243 1.017 . . . . 0.0 111.503 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -58.6 -43.89 89.72 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 122.538 0.335 . . . . 0.0 111.506 177.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -89.04 -39.7 13.48 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 113.113 0.783 . . . . 0.0 113.113 -171.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -79.54 103.67 9.62 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 125.091 1.357 . . . . 0.0 110.533 -169.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -81.05 -18.67 45.9 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 122.848 0.459 . . . . 0.0 111.882 175.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 2.9 p30 -93.41 -28.01 16.39 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 118.218 0.463 . . . . 0.0 111.864 -171.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 23.1 t0 74.67 35.37 0.67 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 127.488 2.315 . . . . 0.0 113.412 174.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -89.67 -5.71 56.82 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 123.591 0.757 . . . . 0.0 111.678 169.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.4 t30 67.08 37.47 3.77 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.527 1.131 . . . . 0.0 110.601 -176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 15.0 mt-10 -141.5 138.85 33.08 Favored 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 107.163 -1.421 . . . . 0.0 107.163 169.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 3.4 mm -87.96 110.54 21.03 Favored 'Isoleucine or valine' 0 C--O 1.231 0.095 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.77 168.99 19.06 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.015 0.436 . . . . 0.0 110.026 172.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 71.5 mt-10 -55.99 -50.4 70.93 Favored 'General case' 0 C--O 1.227 -0.13 0 CA-C-O 118.851 -0.595 . . . . 0.0 112.054 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -53.79 -55.17 28.84 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-N 118.721 0.691 . . . . 0.0 110.405 178.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -51.15 -47.11 62.17 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 0.0 111.045 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -62.36 -54.21 43.78 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 54.9 mt -46.78 -52.63 3.71 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 C-N-CA 124.08 0.952 . . . . 0.0 110.982 174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 15.3 mmp_? -56.27 -55.37 34.21 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.89 0.876 . . . . 0.0 110.016 -179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.7 tt -65.27 -36.41 77.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 119.556 -0.858 . . . . 0.0 111.404 -177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.514 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -54.69 -47.92 73.07 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 123.282 0.633 . . . . 0.0 111.239 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 56.3 mttp -61.48 -59.19 5.62 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 123.503 0.502 . . . . 0.0 110.242 172.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.1 ttmm -41.93 -44.17 3.35 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 125.795 1.638 . . . . 0.0 111.815 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 20.8 m -96.04 -0.99 49.74 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.876 1.271 . . . . 0.0 112.508 -169.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.2 m 59.02 31.16 21.1 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 120.889 -1.132 . . . . 0.0 111.941 -171.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.867 HD23 ' CE1' ' B' ' 253' ' ' PHE . 2.1 mt -77.79 -34.26 52.23 Favored 'General case' 0 CA--C 1.529 0.155 0 N-CA-C 109.333 -0.617 . . . . 0.0 109.333 174.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 50.4 m-85 . . . . . 0 C--O 1.253 1.241 0 CA-C-O 116.93 -1.51 . . . . 0.0 109.087 169.051 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 35.8 mmtp . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 121.269 0.557 . . . . 0.0 111.308 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -79.13 62.49 3.54 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.714 0.805 . . . . 0.0 110.265 -175.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 14.1 ptm180 -172.06 -44.6 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.511 1.524 . . . . 0.0 109.703 169.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -43.21 -51.24 6.19 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.443 1.497 . . . . 0.0 112.203 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.68 -38.84 70.17 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.511 0.56 . . . . 0.0 112.511 -179.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 35.4 mt -79.36 -46.32 23.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -49.42 -43.92 45.0 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 123.535 0.734 . . . . 0.0 110.453 175.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 49.5 m -50.3 -36.74 33.0 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.352 0.661 . . . . 0.0 112.777 175.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -71.99 -52.65 16.02 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.901 -0.499 . . . . 0.0 109.7 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -55.87 -44.27 77.92 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.161 0.437 . . . . 0.0 111.497 176.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.58 ' HA ' HD21 ' A' ' 168' ' ' LEU . 59.7 m170 -45.85 -63.06 1.06 Allowed 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 124.603 1.161 . . . . 0.0 109.198 174.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 12.2 ttp-105 -58.83 -47.72 83.85 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 120.41 -0.516 . . . . 0.0 110.079 -179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 5.4 tp -54.51 -42.41 70.77 Favored 'General case' 0 CA--C 1.538 0.491 0 O-C-N 121.957 -0.465 . . . . 0.0 111.719 -173.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.2 mp -82.62 -64.61 1.14 Allowed 'General case' 0 N--CA 1.463 0.204 0 O-C-N 121.801 -0.562 . . . . 0.0 110.703 173.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.867 ' CE1' HD23 ' A' ' 168' ' ' LEU . 13.0 m-30 -56.32 -25.96 50.61 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 113.57 0.952 . . . . 0.0 113.57 -169.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -61.87 -31.75 72.05 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 119.051 0.842 . . . . 0.0 111.491 173.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -76.32 65.54 2.26 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.63 0.772 . . . . 0.0 110.081 -178.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -75.83 64.58 1.82 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.168 0.987 . . . . 0.0 111.028 -175.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 94.3 mttt . . . . . 0 C--O 1.251 1.151 0 CA-C-O 117.339 -1.315 . . . . 0.0 110.252 171.172 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.204 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 7.9 m -73.4 40.35 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.993 1.317 . . . . 0.0 114.294 -171.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -63.23 -48.49 79.0 Favored Glycine 0 C--N 1.335 0.51 0 N-CA-C 111.207 -0.757 . . . . 0.0 111.207 -178.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -48.2 77.36 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.1 0.56 . . . . 0.0 110.131 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 90.8 mtm-85 -57.84 -53.76 54.53 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 122.816 0.446 . . . . 0.0 109.847 176.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -51.79 -51.55 55.54 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.903 0.32 . . . . 0.0 110.316 177.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 50.2 m -52.53 -50.51 62.72 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 122.423 0.289 . . . . 0.0 110.838 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 54.3 ttp180 -53.83 -51.1 64.64 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.213 0.605 . . . . 0.0 110.788 177.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -60.46 -47.59 85.44 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.892 -0.505 . . . . 0.0 110.714 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -60.89 -45.89 92.81 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 122.938 0.495 . . . . 0.0 110.363 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 56.3 mt -50.25 -52.94 13.34 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 170.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.44 -39.67 95.09 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.247 -0.283 . . . . 0.0 110.749 -174.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 48.7 mttp -54.89 -53.13 59.5 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 118.644 0.657 . . . . 0.0 110.565 171.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -60.16 -43.69 95.6 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.881 -0.512 . . . . 0.0 111.526 -179.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 79.9 t80 -53.12 -53.78 45.34 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 123.717 0.807 . . . . 0.0 109.611 174.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -55.74 -49.98 71.63 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.519 1.128 . . . . 0.0 110.785 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -45.88 92.47 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 122.935 0.494 . . . . 0.0 110.187 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -63.35 -32.26 73.63 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.235 176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 56.0 t0 -74.93 58.74 0.87 Allowed 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.851 1.205 . . . . 0.0 110.616 175.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -53.56 -49.36 67.84 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.564 1.146 . . . . 0.0 110.297 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 44.5 p30 -69.34 -2.58 11.2 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.634 0.976 . . . . 0.0 113.634 -177.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 55.22 45.05 26.61 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.026 0.931 . . . . 0.0 111.046 176.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 29.2 p -85.25 -27.74 25.83 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 124.142 0.977 . . . . 0.0 111.354 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.76 -1.64 56.83 Favored Glycine 0 CA--C 1.533 1.199 0 N-CA-C 110.21 -1.156 . . . . 0.0 110.21 -169.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 60.2 p -137.23 178.66 6.92 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.143 1.377 . . . . 0.0 107.746 177.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 9.3 mt -109.5 137.37 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 N-CA-C 105.693 -1.966 . . . . 0.0 105.693 169.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.1 p -129.17 166.09 20.02 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 118.945 0.793 . . . . 0.0 110.8 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.36 -41.37 25.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 C-N-CA 123.066 0.546 . . . . 0.0 112.282 -175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -60.67 -43.45 97.64 Favored 'General case' 0 CA--C 1.532 0.278 0 O-C-N 122.026 -0.421 . . . . 0.0 110.329 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -62.74 -51.01 68.82 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 85.1 mt -54.89 -49.29 71.56 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 116.137 -0.483 . . . . 0.0 109.791 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 47.7 tpt85 -58.57 -44.84 89.9 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 118.771 -0.633 . . . . 0.0 110.565 179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 25.0 ttm-85 -60.15 -53.42 57.97 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 118.579 0.627 . . . . 0.0 110.467 179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 47.2 t -51.33 -53.1 16.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 N-CA-C 109.241 -0.652 . . . . 0.0 109.241 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.421 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.42 -53.79 53.27 Favored 'General case' 0 N--CA 1.449 -0.513 0 C-N-CA 123.425 0.69 . . . . 0.0 110.045 -177.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 58.0 tttm -46.32 -58.32 3.81 Favored 'General case' 0 C--N 1.339 0.143 0 C-N-CA 124.979 1.312 . . . . 0.0 110.628 175.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -61.76 -39.89 93.23 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 111.466 0.173 . . . . 0.0 111.466 -174.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 92.5 mt -68.25 -22.8 64.75 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.032 0.378 . . . . 0.0 111.656 173.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 120.12 -20.07 9.23 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.484 1.516 . . . . 0.0 111.611 176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.421 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 36.3 mm-40 -70.71 91.6 0.83 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.527 1.131 . . . . 0.0 108.818 -175.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -80.29 71.24 7.06 Favored 'General case' 0 C--N 1.328 -0.328 0 O-C-N 121.478 -0.764 . . . . 0.0 109.318 178.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 92.1 mt -73.8 138.45 44.5 Favored 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 123.905 0.882 . . . . 0.0 110.665 -175.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 69.0 p -68.63 155.92 39.13 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.296 175.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.3 mp0 -50.89 -40.14 55.94 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.571 0.748 . . . . 0.0 109.685 171.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 31.1 mp0 -60.7 -56.56 19.86 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 123.802 0.841 . . . . 0.0 110.51 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -51.91 -48.77 64.01 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.279 0.49 . . . . 0.0 110.578 178.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 89.9 mt -56.86 -47.13 81.13 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 120.96 -0.296 . . . . 0.0 110.841 176.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 71.4 mt-30 -59.57 -34.0 72.14 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 121.444 -0.785 . . . . 0.0 112.41 178.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -62.67 -48.4 79.48 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 118.938 0.79 . . . . 0.0 110.55 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.2 mtp -56.71 -51.77 67.54 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.931 0.396 . . . . 0.0 110.59 177.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.5 mm -48.43 -61.6 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 C-N-CA 124.965 1.306 . . . . 0.0 108.03 175.29 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -55.64 -38.17 69.17 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.818 1.247 . . . . 0.0 111.603 -175.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -56.06 -44.07 78.53 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.976 0.51 . . . . 0.0 111.766 176.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -95.15 -45.09 7.35 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.383 0.882 . . . . 0.0 113.383 -173.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -68.7 106.19 2.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 125.793 1.637 . . . . 0.0 111.232 -169.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 2.8 ppt_? -91.63 -4.75 54.88 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.681 0.622 . . . . 0.0 112.681 174.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 11.3 p30 -93.28 -26.74 17.19 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.725 0.693 . . . . 0.0 111.115 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 24.7 t0 65.94 36.84 5.72 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 127.657 2.383 . . . . 0.0 113.829 174.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 1.3 p-10 -109.96 6.07 22.85 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.941 0.896 . . . . 0.0 112.622 172.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 85.65 -5.1 0.85 Allowed 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 127.425 2.29 . . . . 0.0 113.824 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -97.12 121.98 39.61 Favored 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -178.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 4.7 mm -89.48 115.05 28.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 174.123 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -90.59 175.11 7.17 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.523 0.729 . . . . 0.0 109.501 176.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 69.3 mt-10 -53.4 -49.31 67.54 Favored 'General case' 0 C--O 1.222 -0.395 0 CA-C-O 118.672 -0.68 . . . . 0.0 111.417 177.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -54.39 -59.74 4.28 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.167 0.894 . . . . 0.0 111.155 179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -50.49 -48.18 56.9 Favored 'General case' 0 C--O 1.233 0.22 0 C-N-CA 123.698 0.799 . . . . 0.0 111.512 179.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -63.53 -54.3 38.35 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -178.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 51.0 mt -47.56 -53.37 4.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.126 0.97 . . . . 0.0 110.497 176.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 48.0 mtm-85 -54.45 -55.4 29.21 Favored 'General case' 0 N--CA 1.456 -0.162 0 CA-C-O 119.199 -0.429 . . . . 0.0 110.712 178.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . 0.255 8.8 tt -63.49 -35.93 74.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 118.715 -1.194 . . . . 0.0 111.484 -176.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.407 ' HE3' HD13 ' A' ' 168' ' ' LEU . 2.7 mmm -59.13 -38.71 80.3 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 118.799 0.727 . . . . 0.0 110.75 177.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -62.03 -62.36 1.84 Allowed 'General case' 0 CA--C 1.533 0.293 0 O-C-N 123.396 0.435 . . . . 0.0 110.133 169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 29.8 mtmm -45.21 -51.64 10.39 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.423 0.689 . . . . 0.0 111.237 -174.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.0 m -83.33 4.21 28.25 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.178 0.991 . . . . 0.0 112.481 -171.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.1 m 54.48 35.46 23.37 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 119.94 1.245 . . . . 0.0 111.72 -173.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.684 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.5 OUTLIER -82.56 -39.5 22.22 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 174.715 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 C--O 1.25 1.079 0 CA-C-O 116.902 -1.523 . . . . 0.0 108.221 169.528 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 62.5 mtpt . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -53.69 -48.51 69.46 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.992 0.517 . . . . 0.0 110.574 179.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -50.92 -55.58 16.47 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -56.85 -49.47 75.37 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.421 0.555 . . . . 0.0 110.271 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 62.5 tp -49.59 -46.89 49.64 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.444 0.698 . . . . 0.0 111.38 -178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 3.2 mp -78.92 -60.52 2.2 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 CA-C-N 118.684 0.675 . . . . 0.0 110.407 177.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -55.71 -33.39 64.15 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 124.97 1.308 . . . . 0.0 112.546 -169.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 39.9 p -45.6 -36.34 4.67 Favored 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 123.685 0.794 . . . . 0.0 111.968 174.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -70.31 -58.73 3.43 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.363 0.529 . . . . 0.0 110.259 -178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.9 m95 -49.55 -47.66 48.92 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 118.492 0.587 . . . . 0.0 110.456 175.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 79.1 m-70 -50.81 -62.86 1.35 Allowed 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.757 0.423 . . . . 0.0 110.528 173.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -49.92 -54.46 19.58 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 124.1 0.96 . . . . 0.0 110.626 -176.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 43.9 mt -58.19 -56.07 26.76 Favored 'General case' 0 C--N 1.339 0.138 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 -170.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.448 HD13 HD22 ' A' ' 168' ' ' LEU . 0.3 OUTLIER -68.2 -57.25 6.32 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.963 -170.16 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.684 ' CE1' HD23 ' A' ' 168' ' ' LEU . 16.4 m-30 -57.59 -34.36 69.16 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.837 -178.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -68.09 -59.1 3.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 118.895 0.771 . . . . 0.0 111.058 171.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -61.67 -26.69 68.18 Favored 'General case' 0 CA--C 1.529 0.172 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -170.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.3 tttm -58.34 -30.24 66.56 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 122.843 0.457 . . . . 0.0 111.351 174.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.154 0 CA-C-O 116.876 -1.535 . . . . 0.0 110.579 175.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.251 0 N-CA-C 111.55 -0.62 . . . . 0.0 111.55 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.6 p -76.16 66.7 2.34 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.634 0.773 . . . . 0.0 110.046 -179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -77.68 -161.26 15.17 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 109.926 -1.269 . . . . 0.0 109.926 170.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.7 mp0 -74.86 60.56 0.96 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.134 0.974 . . . . 0.0 109.922 177.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 23.7 mtp-105 -75.33 73.9 2.42 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.866 0.867 . . . . 0.0 109.738 -176.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -39.17 -47.38 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.152 1.381 . . . . 0.0 111.734 176.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 39.8 m 71.12 -56.43 0.63 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.862 1.665 . . . . 0.0 112.2 178.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 59.3 ttp85 -41.92 -55.33 3.14 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.93 2.092 . . . . 0.0 111.793 -176.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -58.74 -51.72 68.76 Favored 'General case' 0 N--CA 1.454 -0.269 0 O-C-N 122.077 -0.389 . . . . 0.0 110.676 -177.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.16 -43.41 95.25 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 122.788 0.435 . . . . 0.0 110.443 -175.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 63.7 mt -49.96 -50.74 18.49 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 169.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -63.0 -38.33 90.78 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 119.463 -0.304 . . . . 0.0 110.902 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 31.4 mmtm -55.51 -52.92 62.08 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 118.836 0.744 . . . . 0.0 110.471 170.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.99 84.64 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 122.087 -0.383 . . . . 0.0 111.307 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 67.2 t80 -51.56 -53.77 34.49 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 123.832 0.853 . . . . 0.0 109.732 175.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 32.5 tpt85 -57.14 -49.88 74.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.119 0.568 . . . . 0.0 110.738 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.09 -44.79 87.82 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.6 m-30 -64.76 -37.16 86.68 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 118.832 -0.604 . . . . 0.0 112.057 176.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -73.46 59.39 0.6 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.135 0.879 . . . . 0.0 112.079 -177.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -55.2 -43.14 74.12 Favored 'General case' 0 CA--C 1.529 0.135 0 C-N-CA 124.911 1.285 . . . . 0.0 110.953 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 29.6 p30 -71.59 -3.24 20.34 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 113.256 0.836 . . . . 0.0 113.256 178.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 56.05 41.74 29.31 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.771 1.228 . . . . 0.0 111.667 173.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 55.4 p -88.08 -19.2 27.38 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 124.118 0.967 . . . . 0.0 112.261 -177.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.37 15.42 71.59 Favored Glycine 0 CA--C 1.534 1.264 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 -168.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 32.3 p -141.85 178.31 7.59 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 125.828 1.651 . . . . 0.0 107.06 174.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 10.7 mt -118.51 124.87 73.81 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.172 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 169.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 70.5 p -107.46 169.31 8.66 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-N 119.114 0.87 . . . . 0.0 111.408 -175.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.6 tt -55.23 -37.74 44.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.402 -0.811 . . . . 0.0 110.929 170.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -59.7 -51.14 71.06 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.972 0.509 . . . . 0.0 109.662 176.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -54.06 -53.06 58.25 Favored 'General case' 0 C--N 1.34 0.167 0 CA-C-O 120.695 0.283 . . . . 0.0 110.365 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 60.5 mt -59.85 -44.59 94.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 119.554 -0.26 . . . . 0.0 110.42 -176.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 9.8 ttp180 -61.52 -45.76 92.82 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 118.227 0.467 . . . . 0.0 110.463 178.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 26.0 tpt180 -53.62 -59.3 4.78 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.107 0.412 . . . . 0.0 110.316 175.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.8 t -48.55 -54.78 4.04 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 C-N-CA 124.545 1.138 . . . . 0.0 110.341 178.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -59.44 -51.84 68.18 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.866 0.466 . . . . 0.0 110.183 -175.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -54.81 -45.53 74.41 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 123.48 0.712 . . . . 0.0 111.985 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -54.15 -37.01 63.93 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.803 0.729 . . . . 0.0 111.131 175.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 18.9 mt -87.88 9.44 22.01 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.996 0.919 . . . . 0.0 111.878 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 87.75 -18.54 38.44 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 125.304 1.43 . . . . 0.0 112.823 179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -74.91 91.51 2.48 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.775 -0.838 . . . . 0.0 109.114 -173.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -78.29 69.68 4.54 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 176.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 88.2 mt -69.93 137.31 51.44 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.521 0.728 . . . . 0.0 109.196 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 49.4 p -78.23 165.08 24.33 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 123.082 0.553 . . . . 0.0 109.517 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -53.96 -37.01 63.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.626 174.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 8.1 tm-20 -63.32 -58.68 6.32 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 109.949 -0.389 . . . . 0.0 109.949 177.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 77.6 mm-40 -54.08 -45.7 71.83 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.538 0.685 . . . . 0.0 110.545 -177.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 95.9 mt -60.2 -46.16 90.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.89 174.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.6 mt-30 -57.11 -34.12 68.03 Favored 'General case' 0 C--O 1.225 -0.226 0 CA-C-N 118.528 0.604 . . . . 0.0 112.156 177.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -59.22 -52.33 66.16 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.651 0.659 . . . . 0.0 110.811 172.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 17.9 mtm -57.22 -52.27 65.98 Favored 'General case' 0 C--O 1.235 0.339 0 O-C-N 121.918 -0.489 . . . . 0.0 111.659 176.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 5.1 mm -47.03 -51.71 5.02 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.423 0 C-N-CA 124.368 1.067 . . . . 0.0 108.393 176.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -65.04 -43.54 92.04 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.115 0.566 . . . . 0.0 111.441 -173.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 -54.48 -47.5 72.91 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 118.792 0.724 . . . . 0.0 110.937 174.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . 0.401 ' HB3' HD13 ' A' ' 154' ' ' ILE . . . -79.5 -45.69 18.85 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.936 0.717 . . . . 0.0 112.936 -172.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -81.28 102.18 10.23 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 123.403 0.681 . . . . 0.0 112.448 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -67.72 -27.59 66.93 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 121.951 -0.468 . . . . 0.0 109.799 169.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 31.9 p30 -75.26 -14.92 60.55 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.605 0.762 . . . . 0.0 112.452 175.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.1 t0 29.62 51.23 0.08 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.803 2.041 . . . . 0.0 114.525 -169.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 23.1 p30 -117.54 15.22 14.63 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.94 0.896 . . . . 0.0 111.942 177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.272 0.0 OUTLIER 79.63 -15.7 0.73 Allowed 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.495 1.918 . . . . 0.0 114.382 -177.561 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -97.93 119.43 36.54 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 119.892 1.224 . . . . 0.0 107.701 -177.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.401 HD13 ' HB3' ' A' ' 146' ' ' ALA . 0.4 OUTLIER -89.22 114.85 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.573 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 175.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -87.72 173.58 8.91 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 177.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.94 -49.0 66.91 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-O 118.767 -0.635 . . . . 0.0 111.791 176.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -57.16 -56.75 17.68 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.99 0.814 . . . . 0.0 110.907 -177.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 -53.13 -48.21 68.07 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.578 0.751 . . . . 0.0 111.233 177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -63.77 -50.37 69.29 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.25 -176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 50.8 mt -48.13 -51.31 9.62 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.048 0.939 . . . . 0.0 109.769 171.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 13.2 ttp-105 -52.57 -57.05 11.22 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.679 0.392 . . . . 0.0 110.729 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.5 tt -66.93 -37.54 79.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.51 -176.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.409 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.0 mmt -58.18 -41.01 82.98 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.753 -0.592 . . . . 0.0 110.863 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 49.8 mtmt -67.33 -56.16 10.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 119.451 -0.309 . . . . 0.0 110.585 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -43.3 -48.67 6.83 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 124.752 1.221 . . . . 0.0 111.384 -178.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 7.4 m -85.01 -1.85 57.29 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.798 0.839 . . . . 0.0 111.926 -171.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.1 m 57.39 37.99 28.17 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 121.384 -0.823 . . . . 0.0 111.168 -170.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.643 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -81.14 -37.02 29.5 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 170.656 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 . . . . . 0 C--O 1.25 1.11 0 CA-C-O 116.948 -1.501 . . . . 0.0 109.055 169.271 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 110.423 -0.214 . . . . 0.0 110.423 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 35.8 mtmm -74.13 79.04 1.75 Allowed 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.657 0.783 . . . . 0.0 109.462 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.53 62.82 0.77 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 123.662 0.785 . . . . 0.0 111.63 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -54.07 -33.23 56.94 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.5 -0.75 . . . . 0.0 112.122 -176.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -56.94 -20.7 24.99 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 177.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 1.6 tp -55.04 -19.85 5.21 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 O-C-N 121.715 -0.616 . . . . 0.0 111.131 171.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -33.16 -46.78 0.17 Allowed 'General case' 0 C--O 1.223 -0.316 0 C-N-CA 126.998 2.119 . . . . 0.0 110.313 168.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 11.6 p -41.95 -42.18 2.71 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.545 1.138 . . . . 0.0 113.326 178.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -73.69 -59.74 2.58 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 122.907 0.483 . . . . 0.0 110.311 -179.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 10.0 m95 -48.91 -43.92 39.83 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 118.723 0.692 . . . . 0.0 110.905 177.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -49.67 -68.57 0.16 Allowed 'General case' 0 C--O 1.231 0.103 0 C-N-CA 126.385 1.874 . . . . 0.0 109.149 169.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 70.0 ttt180 -50.32 -42.43 52.69 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -177.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 41.3 mt -59.64 -32.61 70.6 Favored 'General case' 0 CA--C 1.529 0.159 0 O-C-N 121.562 -0.712 . . . . 0.0 112.096 -175.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -93.73 -72.99 0.58 Allowed 'General case' 0 C--O 1.231 0.125 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 171.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.643 ' CE1' HD23 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -83.83 77.22 9.93 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 107.532 -1.285 . . . . 0.0 107.532 -177.176 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 55.9 t-80 -74.49 61.33 0.93 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.987 1.315 . . . . 0.0 110.664 -179.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -162.89 158.09 22.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 125.995 1.718 . . . . 0.0 106.635 -174.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 94.2 mttt 66.79 -65.66 0.2 Allowed 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.482 1.513 . . . . 0.0 111.767 -176.314 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 24.1 tptm . . . . . 0 C--O 1.249 1.068 0 CA-C-O 116.849 -1.548 . . . . 0.0 108.554 177.601 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.951 0 N-CA-C 110.227 -1.149 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 21.8 p -76.05 64.5 1.94 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.926 0.891 . . . . 0.0 108.614 174.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 70.35 -69.58 0.68 Allowed Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.694 -1.362 . . . . 0.0 109.694 -169.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.02 154.77 36.79 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 169.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.3 mtp85 -69.59 72.16 0.34 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.278 0.631 . . . . 0.0 112.019 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -75.01 70.85 2.05 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 63.7 m -43.94 -38.35 3.38 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.366 1.066 . . . . 0.0 112.587 -173.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -43.77 -54.42 5.17 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.102 0.961 . . . . 0.0 112.182 173.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -68.01 -39.03 83.25 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 121.537 -0.727 . . . . 0.0 109.974 -175.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.69 -49.03 79.17 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.301 0.572 . . . . 0.0 109.847 179.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 62.4 mt -51.34 -53.66 14.62 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 124.142 0.977 . . . . 0.0 109.072 171.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.3 tm? -63.26 -41.95 99.1 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.061 -0.399 . . . . 0.0 110.694 -173.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 90.5 mttt -54.67 -52.3 62.76 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.417 -0.802 . . . . 0.0 110.162 172.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.16 -39.45 78.87 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 177.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -55.0 -52.26 63.68 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.283 0.633 . . . . 0.0 109.375 176.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.4 mmm-85 -62.51 -44.44 96.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 119.156 -0.45 . . . . 0.0 111.341 177.266 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.32 -48.98 73.33 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 118.692 0.678 . . . . 0.0 109.579 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . 0.43 ' CZ ' HD12 ' B' ' 251' ' ' LEU . 16.6 m-30 -64.38 -47.2 80.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 118.932 -0.556 . . . . 0.0 111.234 177.418 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.4 t0 -74.3 60.62 0.84 Allowed 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 118.771 0.714 . . . . 0.0 111.252 -177.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -50.94 -45.51 60.62 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.937 1.695 . . . . 0.0 111.713 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -73.97 -6.1 45.31 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 -179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.57 47.4 18.65 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.049 1.339 . . . . 0.0 111.606 176.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 70.7 m -73.88 -15.74 61.14 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.824 -0.547 . . . . 0.0 112.021 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 84.12 7.51 85.16 Favored Glycine 0 CA--C 1.533 1.189 0 N-CA-C 110.133 -1.187 . . . . 0.0 110.133 -169.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 42.4 p -151.01 150.27 30.56 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.338 2.255 . . . . 0.0 105.035 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 20.3 mt -91.74 111.28 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.141 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 -179.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -90.16 164.45 14.44 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 119.053 0.842 . . . . 0.0 111.967 -176.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -52.1 -38.94 25.17 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.061 169.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.35 -49.2 77.9 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 176.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -54.68 -54.09 46.36 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 81.5 mt -56.38 -49.77 73.49 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.401 -178.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -57.22 -50.11 73.9 Favored 'General case' 0 C--N 1.338 0.088 0 CA-C-N 118.36 0.527 . . . . 0.0 110.194 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 1.6 ttt85 -54.82 -55.76 26.78 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 117.802 0.274 . . . . 0.0 110.479 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 79.5 t -56.85 -47.99 82.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 122.365 0.266 . . . . 0.0 110.593 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.99 -51.57 69.09 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.837 -0.539 . . . . 0.0 110.369 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.3 tptp -54.4 -49.12 70.65 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.855 0.862 . . . . 0.0 110.589 176.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -57.8 -41.23 81.72 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 118.189 0.45 . . . . 0.0 111.628 176.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 28.5 mt -66.39 -25.74 66.92 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 122.046 -0.409 . . . . 0.0 111.302 174.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.21 -14.1 30.97 Favored Glycine 0 CA--C 1.53 1.002 0 C-N-CA 125.465 1.507 . . . . 0.0 111.17 -175.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -72.43 91.28 1.36 Allowed 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -179.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -77.3 69.97 3.63 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 85.6 mt -71.96 145.55 48.33 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 123.315 0.646 . . . . 0.0 110.016 -179.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.9 p -77.19 155.53 32.18 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.436 0.694 . . . . 0.0 110.144 174.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -49.37 -42.07 40.99 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.023 0.529 . . . . 0.0 109.682 169.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.32 -57.65 11.71 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.718 0.807 . . . . 0.0 110.775 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -52.94 -47.53 68.01 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.143 0.429 . . . . 0.0 110.787 178.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 74.4 mt -57.62 -42.99 84.43 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.904 -0.318 . . . . 0.0 111.143 176.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -64.39 -32.6 74.28 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.189 -0.944 . . . . 0.0 112.268 176.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 58.7 mt-10 -61.92 -48.99 77.95 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.687 1.13 . . . . 0.0 110.027 170.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 91.1 mtp -54.57 -53.54 53.19 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 122.179 -0.326 . . . . 0.0 111.01 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.3 mm -50.46 -61.76 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 C-N-CA 124.788 1.235 . . . . 0.0 107.87 176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.65 -37.31 73.15 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.054 0.942 . . . . 0.0 112.016 -173.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -59.81 -39.52 85.28 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 118.072 0.397 . . . . 0.0 111.358 177.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -92.36 -43.66 9.13 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -174.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -70.15 135.26 48.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 127.14 2.176 . . . . 0.0 111.282 -169.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -133.09 15.67 4.19 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.139 0.976 . . . . 0.0 112.599 174.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -113.2 -31.86 6.48 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 124.718 1.207 . . . . 0.0 111.166 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 21.9 t0 84.39 13.95 0.27 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.56 2.344 . . . . 0.0 114.14 172.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 40.5 p-10 -66.83 -15.84 63.87 Favored 'General case' 0 N--CA 1.465 0.294 0 O-C-N 120.901 -1.124 . . . . 0.0 110.128 169.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 67.28 42.01 2.36 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 126.267 1.827 . . . . 0.0 110.633 -178.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -137.5 142.25 41.48 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 104.637 -2.356 . . . . 0.0 104.637 169.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.2 mm -80.9 119.17 30.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -86.39 172.95 10.01 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 170.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -54.7 -52.79 61.31 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-O 119.008 -0.52 . . . . 0.0 112.052 -178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -54.29 -53.8 48.78 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.907 0.776 . . . . 0.0 111.318 -179.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -54.31 -48.7 71.04 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.476 0.71 . . . . 0.0 109.916 -179.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 39.5 t80 -62.69 -55.18 29.21 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.065 -177.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 55.5 mt -45.98 -55.29 1.48 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 124.169 0.988 . . . . 0.0 109.894 175.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -55.01 -53.08 60.37 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 119.345 -0.359 . . . . 0.0 110.766 -178.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 13.2 tt -66.16 -38.62 82.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 119.453 -0.899 . . . . 0.0 112.112 -177.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 6.5 mmm -60.92 -39.78 90.7 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 119.011 0.823 . . . . 0.0 110.327 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -63.97 -59.12 4.89 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.403 0.281 . . . . 0.0 110.412 173.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -40.19 -46.13 2.17 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 126.052 1.741 . . . . 0.0 111.726 -179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.464 ' CG2' HD12 ' A' ' 168' ' ' LEU . 17.1 m -90.84 0.25 57.52 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.304 1.042 . . . . 0.0 113.065 -169.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 7.6 m 61.71 29.09 17.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.614 1.097 . . . . 0.0 111.865 -171.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.682 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.7 OUTLIER -80.44 -34.39 36.08 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 178.13 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.1 m-85 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 117.045 -1.455 . . . . 0.0 109.231 169.449 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 67.3 mttm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 120.848 0.356 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 85.2 tttt 41.12 -98.59 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.663 1.985 . . . . 0.0 112.051 176.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 53.2 ttt180 -38.9 -52.48 1.76 Allowed 'General case' 0 C--N 1.341 0.218 0 C-N-CA 125.006 1.322 . . . . 0.0 110.566 175.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -46.61 -50.45 17.52 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.6 1.16 . . . . 0.0 110.776 -178.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 46.8 mt -60.24 -38.39 83.29 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 122.92 0.488 . . . . 0.0 110.348 -176.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 17.7 mm -80.79 -53.34 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -174.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -59.47 -29.16 67.62 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 122.022 -0.423 . . . . 0.0 111.376 -177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 56.9 m -47.01 -36.05 7.4 Favored 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 170.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 11.6 mptt -62.77 -50.93 69.11 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 119.452 1.024 . . . . 0.0 110.395 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -54.83 -46.23 74.57 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 119.35 0.977 . . . . 0.0 110.867 174.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -53.22 -53.74 46.22 Favored 'General case' 0 C--O 1.232 0.132 0 O-C-N 123.179 0.299 . . . . 0.0 110.682 177.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -63.85 -51.9 62.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 120.005 -0.678 . . . . 0.0 109.798 -177.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . 0.43 HD12 ' CZ ' ' A' ' 110' ' ' PHE . 0.4 OUTLIER -55.48 -50.84 68.83 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.075 0.95 . . . . 0.0 109.758 -172.019 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.404 HD22 ' CZ ' ' A' ' 110' ' ' PHE . 0.2 OUTLIER -65.41 -59.97 3.45 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.715 0.406 . . . . 0.0 110.165 177.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.682 ' CE1' HD23 ' A' ' 168' ' ' LEU . 14.4 m-85 -67.54 -22.25 65.42 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 121.356 -0.84 . . . . 0.0 112.735 -169.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -76.88 -16.69 59.33 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.421 1.488 . . . . 0.0 111.293 173.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -51.25 124.8 12.5 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 118.888 0.767 . . . . 0.0 111.83 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 62.8 mttp -75.99 64.64 1.92 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.643 0.777 . . . . 0.0 109.247 177.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 22.7 tptm . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.04 -1.457 . . . . 0.0 110.965 -175.022 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.309 0 N-CA-C 111.547 -0.621 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.1 p -72.74 75.88 1.12 Allowed 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 122.098 -0.648 . . . . 0.0 109.477 178.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -48.64 -47.76 29.67 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.252 -1.139 . . . . 0.0 110.252 174.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -91.52 95.71 10.09 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . 0.417 ' H ' ' NE ' ' A' ' 97' ' ' ARG . 0.0 OUTLIER -64.52 130.52 44.01 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.897 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.91 150.53 45.64 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 169.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 13.0 m -40.52 -48.0 2.76 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 125.038 1.335 . . . . 0.0 113.095 176.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -53.52 -55.49 25.06 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 122.862 0.465 . . . . 0.0 111.962 -169.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.2 pm0 -60.92 -41.73 96.74 Favored 'General case' 0 CA--C 1.531 0.248 0 O-C-N 121.632 -0.668 . . . . 0.0 110.859 -177.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -62.94 -47.42 83.28 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.146 0.43 . . . . 0.0 110.208 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 61.5 mt -50.98 -50.97 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 123.928 0.891 . . . . 0.0 109.431 172.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.408 HD22 ' HA ' ' A' ' 104' ' ' LEU . 1.4 tm? -65.97 -41.07 91.64 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 122.276 -0.265 . . . . 0.0 110.79 -173.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -55.06 -55.52 30.07 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.553 -0.717 . . . . 0.0 109.845 170.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.34 -41.22 75.73 Favored 'General case' 0 CA--C 1.53 0.19 0 N-CA-C 112.081 0.401 . . . . 0.0 112.081 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -51.24 -52.89 40.56 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.573 1.149 . . . . 0.0 109.952 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 87.1 mtt-85 -76.93 -28.23 55.18 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 113.288 0.847 . . . . 0.0 113.288 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.15 -46.04 83.07 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 119.834 1.197 . . . . 0.0 108.725 170.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -65.7 -56.21 13.32 Favored 'General case' 0 N--CA 1.452 -0.364 0 O-C-N 122.349 -0.219 . . . . 0.0 111.329 175.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 39.5 t0 -72.64 70.77 0.95 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.723 0.409 . . . . 0.0 110.866 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -48.25 -45.82 34.83 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.986 1.314 . . . . 0.0 111.229 172.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -54.4 -29.29 48.43 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.459 0.704 . . . . 0.0 111.978 176.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 12.7 m-80 64.56 23.82 12.94 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 126.089 1.756 . . . . 0.0 113.604 171.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 13.0 p -55.11 -37.19 66.56 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-O 121.727 0.775 . . . . 0.0 110.142 169.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 104.64 27.01 6.21 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 126.707 2.099 . . . . 0.0 107.936 -168.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 76.4 p -153.03 133.06 13.36 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.429 1.492 . . . . 0.0 107.97 176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 6.0 mt -86.59 128.01 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 O-C-N 120.83 -1.168 . . . . 0.0 108.178 -177.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.4 p -105.15 168.39 9.09 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.486 1.039 . . . . 0.0 111.634 178.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -51.38 -39.82 22.61 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.408 0 O-C-N 122.069 -0.394 . . . . 0.0 111.563 171.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -60.37 -48.79 80.24 Favored 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 178.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 39.3 m-20 -57.27 -49.28 76.55 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 87.0 mt -58.69 -47.92 82.87 Favored 'General case' 0 CA--C 1.53 0.195 0 O-C-N 122.217 -0.302 . . . . 0.0 111.308 -178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 13.7 tpt180 -62.19 -44.39 96.7 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 119.74 -0.784 . . . . 0.0 110.279 178.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -52.48 -56.21 16.7 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 119.128 0.876 . . . . 0.0 110.236 176.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 41.7 t -49.98 -58.07 1.8 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 123.918 0.887 . . . . 0.0 110.144 178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -58.55 -48.26 81.49 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.221 -174.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 41.7 ttmt -55.68 -45.06 77.82 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 125.088 1.355 . . . . 0.0 111.093 177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -55.74 -39.14 70.74 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 119.055 0.843 . . . . 0.0 111.481 175.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 62.5 mt -73.92 -12.86 60.78 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 104.21 -17.59 47.45 Favored Glycine 0 CA--C 1.531 1.042 0 C-N-CA 125.659 1.599 . . . . 0.0 111.44 -174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -76.74 90.24 3.42 Favored 'General case' 0 N--CA 1.448 -0.551 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -79.91 70.08 6.4 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.47 138.49 58.54 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.345 0.593 . . . . 0.0 111.144 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.4 p -68.76 157.48 36.29 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.439 0.695 . . . . 0.0 110.185 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -47.77 -44.22 28.11 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 170.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -58.74 -59.3 5.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 122.879 0.472 . . . . 0.0 110.94 178.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -53.34 -48.21 68.7 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 118.403 0.547 . . . . 0.0 110.726 -179.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 38.0 mt -55.07 -47.42 74.9 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.491 175.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -63.04 -32.75 74.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 121.523 -0.736 . . . . 0.0 112.089 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -63.25 -48.47 78.05 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.79 0.723 . . . . 0.0 110.372 171.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 62.9 mtp -55.06 -52.69 62.39 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.882 0.372 . . . . 0.0 110.397 177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.602 ' HA ' HD11 ' A' ' 154' ' ' ILE . 5.0 mm -48.08 -62.2 0.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.417 0 C-N-CA 124.964 1.306 . . . . 0.0 108.459 175.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.07 -39.79 75.64 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 125.085 1.354 . . . . 0.0 111.857 -173.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -57.05 -48.1 79.36 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.134 0.573 . . . . 0.0 110.991 178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . 0.562 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -87.65 -40.88 13.8 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-O 121.013 0.435 . . . . 0.0 112.121 -174.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -77.89 103.91 8.12 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 124.199 1.0 . . . . 0.0 111.401 -169.765 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.3 ptt85 -84.56 -18.38 35.82 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.238 0.615 . . . . 0.0 111.501 169.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -83.44 -14.26 52.95 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 118.424 0.556 . . . . 0.0 111.977 -178.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 2.0 p30 60.21 16.77 6.35 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 128.081 2.553 . . . . 0.0 115.977 174.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -95.9 6.15 49.56 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 119.282 0.946 . . . . 0.0 112.334 178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.273 0.0 OUTLIER 83.86 -8.94 1.01 Allowed 'General case' 0 N--CA 1.461 0.106 0 C-N-CA 128.151 2.58 . . . . 0.0 113.708 -177.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -96.89 121.05 38.34 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 107.497 -1.298 . . . . 0.0 107.497 -174.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.602 HD11 ' HA ' ' A' ' 143' ' ' ILE . 11.4 mm -81.44 108.46 14.67 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.048 -1.834 . . . . 0.0 106.048 174.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.3 p30 -84.42 173.9 10.52 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.199 0.6 . . . . 0.0 110.078 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -58.48 -50.07 75.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.789 -174.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.15 -50.23 73.46 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 122.975 0.51 . . . . 0.0 111.094 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -55.17 -45.74 75.77 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.099 0.56 . . . . 0.0 110.655 177.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.4 t80 -65.86 -48.66 70.83 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.99 -0.444 . . . . 0.0 110.835 -179.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 46.6 mt -48.35 -56.8 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 124.165 0.986 . . . . 0.0 110.523 173.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 46.6 ptt85 -58.9 -45.9 89.15 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.555 -175.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 7.2 tt -68.81 -40.69 81.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 119.339 -0.944 . . . . 0.0 111.546 -177.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 15.8 mmt -57.16 -42.03 80.32 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.155 -0.341 . . . . 0.0 110.838 177.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -66.71 -58.91 4.14 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.548 0.339 . . . . 0.0 110.801 174.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -40.64 -51.01 3.04 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 125.707 1.603 . . . . 0.0 111.529 179.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 9.1 m -85.57 0.7 51.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.806 -169.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.4 m 56.54 37.83 29.14 Favored 'General case' 0 CA--C 1.532 0.263 0 O-C-N 121.549 -0.719 . . . . 0.0 111.3 -172.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.69 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.9 OUTLIER -81.69 -34.61 30.56 Favored 'General case' 0 CA--C 1.53 0.181 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.907 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 42.8 m-85 . . . . . 0 C--O 1.252 1.186 0 CA-C-O 117.017 -1.468 . . . . 0.0 109.626 169.004 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.5 tptm . . . . . 0 N--CA 1.475 0.804 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -133.63 -171.74 2.79 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.869 1.268 . . . . 0.0 108.61 177.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 22.5 mtp-105 67.62 -68.55 0.16 Allowed 'General case' 0 C--O 1.227 -0.096 0 C-N-CA 125.698 1.599 . . . . 0.0 110.695 -169.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 8.4 mp0 -64.17 -29.06 70.19 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.108 0.963 . . . . 0.0 111.195 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.8 mp -75.44 75.33 2.51 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 169.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 16.4 mm -48.06 -39.99 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 125.298 1.439 . . . . 0.0 111.722 -169.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -40.8 -39.39 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.999 1.719 . . . . 0.0 112.213 175.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 23.3 m -46.17 -36.08 5.66 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.968 1.307 . . . . 0.0 112.756 177.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.6 -63.87 0.98 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 50.0 m95 -50.86 -44.69 59.65 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 122.995 0.518 . . . . 0.0 110.542 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -48.08 -66.39 0.41 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.154 1.382 . . . . 0.0 110.426 169.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -56.5 -41.91 77.48 Favored 'General case' 0 N--CA 1.455 -0.195 0 C-N-CA 123.66 0.784 . . . . 0.0 111.762 -174.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 32.2 mt -58.13 -52.26 66.28 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.283 0.492 . . . . 0.0 110.674 -175.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.479 HD22 HD22 ' A' ' 168' ' ' LEU . 7.4 mp -72.48 -59.16 2.86 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 178.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.69 ' CE1' HD23 ' A' ' 168' ' ' LEU . 3.0 m-30 -74.0 34.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.148 0.979 . . . . 0.0 112.005 -174.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 26.7 t-80 -75.23 -30.76 60.64 Favored 'General case' 0 CA--C 1.528 0.124 0 O-C-N 121.131 -0.98 . . . . 0.0 110.608 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 19.9 t70 69.08 -58.02 0.51 Allowed 'General case' 0 C--N 1.343 0.286 0 C-N-CA 127.254 2.222 . . . . 0.0 111.609 -175.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -68.47 75.56 0.26 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.751 1.62 . . . . 0.0 109.325 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt . . . . . 0 C--O 1.25 1.127 0 C-N-CA 125.49 1.516 . . . . 0.0 109.127 176.058 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.227 0 N-CA-C 111.546 -0.622 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 19.7 m -64.77 -31.61 72.92 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.831 0.452 . . . . 0.0 111.737 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.64 -69.16 1.8 Allowed Glycine 0 CA--C 1.526 0.739 0 N-CA-C 111.031 -0.828 . . . . 0.0 111.031 179.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.53 148.51 37.64 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 123.438 0.695 . . . . 0.0 110.858 -179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -76.73 41.85 0.28 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.131 0.972 . . . . 0.0 112.817 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -102.09 -63.5 1.15 Allowed 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 102.504 -3.147 . . . . 0.0 102.504 168.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 69.8 m 44.74 36.02 1.66 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.387 1.475 . . . . 0.0 112.205 175.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -60.82 -42.07 96.94 Favored 'General case' 0 N--CA 1.456 -0.151 0 C-N-CA 123.317 0.647 . . . . 0.0 110.866 -169.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -57.9 -44.25 86.66 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 176.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -68.17 -44.89 74.94 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 -177.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 81.4 mt -50.48 -51.52 18.58 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 170.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -66.67 -40.3 88.53 Favored 'General case' 0 N--CA 1.451 -0.388 0 O-C-N 122.246 -0.284 . . . . 0.0 110.692 -172.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -54.72 -53.77 50.62 Favored 'General case' 0 CA--C 1.532 0.28 0 O-C-N 121.859 -0.526 . . . . 0.0 110.375 170.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.36 -45.66 84.18 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.574 0.624 . . . . 0.0 111.751 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -50.68 -52.89 35.7 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.022 0.929 . . . . 0.0 109.511 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 18.3 tpt180 -68.53 -38.86 81.21 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 118.978 -0.534 . . . . 0.0 111.548 -177.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -46.49 81.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 119.13 0.877 . . . . 0.0 109.365 175.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 20.1 m-30 -63.95 -46.9 82.63 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 119.482 -0.294 . . . . 0.0 111.145 176.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 46.3 t0 -74.01 61.47 0.82 Allowed 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 118.711 0.687 . . . . 0.0 110.155 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 39.2 t70 -58.14 -35.58 71.71 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 124.208 1.003 . . . . 0.0 110.44 177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.71 -16.26 47.55 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.561 0.744 . . . . 0.0 112.455 174.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 67.93 22.53 8.59 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.515 1.526 . . . . 0.0 112.197 173.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -66.39 -36.26 82.4 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 -172.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 119.88 -17.37 10.06 Favored Glycine 0 CA--C 1.532 1.133 0 C-N-CA 124.806 1.193 . . . . 0.0 111.405 -169.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 41.5 p -139.79 155.37 47.33 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 125.852 1.661 . . . . 0.0 107.317 178.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 12.6 mt -90.96 114.83 28.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.4 p -90.11 163.63 14.78 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 119.717 1.144 . . . . 0.0 112.275 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 4.4 tp -48.69 -41.44 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 124.037 0.935 . . . . 0.0 110.281 169.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -66.42 -45.58 79.42 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 122.801 0.441 . . . . 0.0 111.065 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -51.81 -52.48 48.84 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-N 118.352 0.524 . . . . 0.0 109.61 174.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 66.0 mt -56.61 -46.0 81.16 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 118.98 -0.533 . . . . 0.0 110.392 -178.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 10.1 ttp-105 -58.72 -51.53 69.55 Favored 'General case' 0 C--N 1.34 0.187 0 CA-C-N 118.986 0.812 . . . . 0.0 111.475 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.8 mtp180 -48.88 -58.92 4.08 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 121.847 0.832 . . . . 0.0 109.819 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 76.7 t -55.83 -51.67 57.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-N 115.046 -0.979 . . . . 0.0 110.013 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -57.59 -55.7 31.5 Favored 'General case' 0 N--CA 1.452 -0.364 0 C-N-CA 122.963 0.505 . . . . 0.0 110.531 -176.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -61.65 -37.77 85.26 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.607 -178.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -61.65 -43.74 98.29 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.436 0.562 . . . . 0.0 111.423 174.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 26.8 mt -63.98 -25.5 68.16 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 118.29 0.495 . . . . 0.0 110.831 172.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 126.9 -27.74 4.8 Favored Glycine 0 CA--C 1.529 0.91 0 C-N-CA 126.032 1.777 . . . . 0.0 111.131 177.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -73.44 90.94 1.73 Allowed 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 123.649 0.78 . . . . 0.0 109.472 -173.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -77.22 70.37 3.6 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 70.3 mt -70.51 146.84 49.95 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.153 0.981 . . . . 0.0 109.886 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 63.1 p -79.68 163.97 24.12 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.109 0.563 . . . . 0.0 110.203 179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -45.71 -51.06 13.03 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.923 0.889 . . . . 0.0 109.777 171.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 41.9 mp0 -60.02 -54.19 48.89 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.333 1.053 . . . . 0.0 110.601 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -52.95 -45.85 67.89 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.154 0.502 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 16.8 mt -66.46 -39.95 89.11 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.76 177.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -58.89 -39.58 81.87 Favored 'General case' 0 C--O 1.222 -0.344 0 O-C-N 121.598 -0.689 . . . . 0.0 109.804 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -59.13 -50.78 72.76 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.899 -0.501 . . . . 0.0 110.563 175.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 80.0 mtp -53.03 -48.15 67.83 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 122.746 0.418 . . . . 0.0 110.702 176.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.411 HG21 ' HA ' ' A' ' 152' ' ' ASN . 0.6 OUTLIER -55.08 -63.84 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.459 175.747 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -50.85 -38.83 51.45 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 119.544 1.066 . . . . 0.0 111.867 -176.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.38 -39.2 89.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 176.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -93.95 -56.68 2.78 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.023 0.929 . . . . 0.0 112.239 -174.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -64.17 101.48 0.41 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.832 2.053 . . . . 0.0 109.54 -176.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -72.25 -10.3 59.6 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.8 -0.563 . . . . 0.0 112.179 -173.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -108.73 -7.25 15.62 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.854 0.862 . . . . 0.0 112.701 172.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.4 t0 42.57 41.8 2.51 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 126.402 1.881 . . . . 0.0 114.841 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 31.6 p-10 -73.56 -31.06 63.43 Favored 'General case' 0 N--CA 1.465 0.28 0 O-C-N 121.042 -1.036 . . . . 0.0 110.829 170.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . 0.411 ' HA ' HG21 ' A' ' 143' ' ' ILE 0.28 30.4 m-80 109.85 26.41 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.254 0 C-N-CA 130.269 3.428 . . . . 0.0 111.759 -176.441 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -125.9 121.81 34.24 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 169.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 2.6 mm -84.31 113.26 22.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 N-CA-C 105.537 -2.023 . . . . 0.0 105.537 169.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -84.59 170.69 13.14 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 121.295 0.569 . . . . 0.0 109.94 172.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.06 -50.86 72.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.791 -173.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -52.96 -56.3 17.02 Favored 'General case' 0 N--CA 1.462 0.172 0 C-N-CA 123.213 0.605 . . . . 0.0 110.625 177.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -52.52 -49.11 65.48 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.267 0.627 . . . . 0.0 110.417 -179.355 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -62.4 -51.08 68.98 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.404 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 41.7 mt -48.85 -53.14 7.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.321 0 C-N-CA 123.822 0.849 . . . . 0.0 109.177 174.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.84 -56.37 16.28 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.209 1.004 . . . . 0.0 110.216 -177.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 9.0 tt -64.99 -38.78 83.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.219 0 C-N-CA 119.903 -0.719 . . . . 0.0 112.016 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.78 -32.96 69.78 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 122.047 -0.408 . . . . 0.0 110.993 178.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -73.31 -54.19 8.98 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-O 117.89 -1.052 . . . . 0.0 110.603 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 56.1 mttm -41.23 -58.32 1.84 Allowed 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 119.588 1.086 . . . . 0.0 111.677 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.478 ' HB ' HD12 ' A' ' 168' ' ' LEU . 54.1 m -92.6 17.86 9.55 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.606 0.762 . . . . 0.0 110.902 -170.579 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 24.6 m 53.11 38.42 27.39 Favored 'General case' 0 CA--C 1.532 0.277 0 O-C-N 121.23 -0.919 . . . . 0.0 112.515 174.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.513 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.9 mt -81.77 -34.94 30.11 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 172.7 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 116.809 -1.567 . . . . 0.0 108.972 169.574 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 64.6 mttp . . . . . 0 N--CA 1.477 0.892 0 N-CA-C 111.208 0.077 . . . . 0.0 111.208 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 24.4 tptm -52.32 123.44 10.81 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 176.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 11.7 ttt85 70.44 -58.72 0.54 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.661 1.585 . . . . 0.0 111.005 -173.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -42.52 -49.82 5.33 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.831 1.652 . . . . 0.0 112.484 -177.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 9.5 tt -51.21 -42.94 61.26 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.28 1.032 . . . . 0.0 111.297 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 63.7 mt -82.25 -45.37 19.77 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.671 -0.863 . . . . 0.0 108.671 -176.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -48.34 -45.46 35.39 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 123.15 0.58 . . . . 0.0 111.1 175.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.3 m -45.01 -34.74 2.6 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.476 1.11 . . . . 0.0 112.391 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -71.49 -57.11 4.72 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.709 -0.662 . . . . 0.0 110.101 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 23.5 m95 -50.15 -46.2 53.84 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.234 0.924 . . . . 0.0 110.139 174.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -49.32 -56.42 9.57 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.157 0.983 . . . . 0.0 110.706 171.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 38.6 ttm180 -63.06 -43.51 98.42 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 118.955 0.798 . . . . 0.0 111.411 -177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -58.68 -57.84 11.2 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 118.925 0.784 . . . . 0.0 110.264 -179.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -64.51 -59.91 3.76 Favored 'General case' 0 CA--C 1.531 0.219 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 -177.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.513 ' CE1' HD23 ' A' ' 168' ' ' LEU . 6.7 m-85 -85.3 38.22 0.72 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.96 0.904 . . . . 0.0 110.548 -173.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 63.5 t-80 -70.42 -47.8 59.03 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 118.632 0.651 . . . . 0.0 111.201 -170.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 43.1 t0 65.56 166.27 0.18 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.07 1.348 . . . . 0.0 111.114 -172.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -75.11 69.63 2.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.277 1.031 . . . . 0.0 109.577 -179.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 59.7 mttp . . . . . 0 C--O 1.251 1.141 0 CA-C-O 117.292 -1.337 . . . . 0.0 110.405 172.985 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.241 0 N-CA-C 111.156 -0.777 . . . . 0.0 111.156 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 3.8 m -65.38 67.32 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 126.277 1.831 . . . . 0.0 113.529 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 37.02 -121.86 0.8 Allowed Glycine 0 CA--C 1.528 0.859 0 C-N-CA 126.826 2.155 . . . . 0.0 113.177 172.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -57.46 -43.61 84.15 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.443 0.697 . . . . 0.0 111.106 -177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -41.67 96.52 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 110.158 -0.312 . . . . 0.0 110.158 -175.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -67.04 -48.66 67.63 Favored 'General case' 0 C--N 1.333 -0.12 0 O-C-N 122.169 -0.332 . . . . 0.0 110.181 173.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 46.3 m -49.58 -43.51 46.28 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 122.757 0.423 . . . . 0.0 110.609 178.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -47.23 -48.91 24.1 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.761 0.824 . . . . 0.0 111.417 173.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 41.9 mm-40 -64.77 -47.6 77.55 Favored 'General case' 0 N--CA 1.456 -0.174 0 O-C-N 121.905 -0.497 . . . . 0.0 110.306 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -59.35 -48.05 83.09 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.328 0.585 . . . . 0.0 110.219 -178.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.8 mt -50.73 -53.16 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.564 1.145 . . . . 0.0 110.001 171.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -65.14 -41.1 95.11 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.16 0.436 . . . . 0.0 110.49 -173.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -56.21 -51.6 67.46 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 121.669 -0.644 . . . . 0.0 110.375 172.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.15 -46.58 79.21 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.501 0.591 . . . . 0.0 111.867 176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -52.85 -50.38 63.87 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.645 1.178 . . . . 0.0 109.921 177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -67.75 -43.13 80.6 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 119.01 -0.519 . . . . 0.0 111.661 -179.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.26 -42.45 86.47 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.026 0.83 . . . . 0.0 109.55 176.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 10.1 m-30 -62.79 -55.78 23.41 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.188 0.195 . . . . 0.0 110.675 174.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -73.84 72.37 1.55 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.278 0.631 . . . . 0.0 110.829 -173.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.41 -40.75 59.95 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.594 0.758 . . . . 0.0 111.245 172.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 6.9 t70 -59.12 -22.32 60.67 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.148 1.379 . . . . 0.0 112.252 175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 10.0 p30 54.34 17.98 1.72 Allowed 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.13 2.172 . . . . 0.0 115.646 170.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 31.8 p -60.21 -28.99 68.44 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.814 -0.554 . . . . 0.0 111.086 169.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 99.37 30.62 6.5 Favored Glycine 0 CA--C 1.527 0.804 0 N-CA-C 109.029 -1.628 . . . . 0.0 109.029 -169.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 71.2 p -150.5 129.92 12.95 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.209 1.404 . . . . 0.0 107.746 172.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.02 118.94 31.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 31.3 p -99.05 169.24 9.56 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.9 0.773 . . . . 0.0 111.022 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.2 tp -45.46 -42.76 3.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 124.626 1.17 . . . . 0.0 111.433 171.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -62.77 -48.13 80.49 Favored 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 123.103 0.561 . . . . 0.0 110.152 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -56.81 -50.78 71.34 Favored 'General case' 0 CA--C 1.528 0.105 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.99 -52.2 63.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 119.78 -0.153 . . . . 0.0 111.027 179.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -57.54 -45.94 84.48 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-O 119.387 -0.339 . . . . 0.0 110.327 178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 32.6 tpt85 -56.48 -54.22 48.31 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.23 0.468 . . . . 0.0 110.117 -178.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 62.6 t -52.79 -53.23 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.459 0.012 0 C-N-CA 124.146 0.978 . . . . 0.0 109.769 177.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -56.81 -50.38 72.52 Favored 'General case' 0 N--CA 1.448 -0.535 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -177.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -57.36 -40.42 78.06 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 124.542 1.137 . . . . 0.0 111.604 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -53.17 -39.54 63.67 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 119.396 0.998 . . . . 0.0 111.637 173.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 40.2 mt -85.56 5.72 30.32 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.892 0.477 . . . . 0.0 111.509 178.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 79.35 -2.18 72.74 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.218 0.913 . . . . 0.0 112.418 -175.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -75.49 90.76 2.74 Favored 'General case' 0 N--CA 1.448 -0.536 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 -177.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.72 70.34 4.08 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 96.9 mt -73.06 135.69 44.88 Favored 'General case' 0 CA--C 1.529 0.152 0 N-CA-C 109.605 -0.516 . . . . 0.0 109.605 -177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 68.6 p -76.46 161.65 28.47 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 123.967 0.907 . . . . 0.0 109.853 178.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -47.68 -42.84 25.69 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 123.068 0.547 . . . . 0.0 110.685 173.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -64.27 -53.01 55.65 Favored 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 117.606 0.184 . . . . 0.0 110.916 -178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -56.73 -47.95 78.86 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 121.209 0.528 . . . . 0.0 110.071 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 35.6 mt -56.24 -47.02 79.33 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.409 175.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 59.5 mt-30 -64.85 -32.53 74.28 Favored 'General case' 0 C--O 1.225 -0.23 0 O-C-N 121.573 -0.705 . . . . 0.0 112.28 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -60.44 -48.05 83.46 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 119.464 1.029 . . . . 0.0 110.391 171.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.2 mtp -57.91 -53.01 63.06 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 177.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.67 ' HA ' HD11 ' A' ' 154' ' ' ILE . 7.9 mm -44.46 -61.6 0.36 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 173.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -64.75 -9.42 20.13 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.82 1.648 . . . . 0.0 113.123 -175.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -80.1 -43.24 22.08 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.286 0.948 . . . . 0.0 109.841 172.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . 0.54 ' HB3' HD12 ' A' ' 154' ' ' ILE . . . -93.9 -50.68 5.23 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 120.714 0.293 . . . . 0.0 111.663 -177.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 60.5 t0 -55.67 120.07 6.7 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 126.596 1.959 . . . . 0.0 110.628 -177.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 33.4 ptt-85 -79.37 -25.49 42.2 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -120.5 0.48 10.51 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -169.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.7 t0 59.9 27.42 16.77 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.854 1.261 . . . . 0.0 112.797 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 48.1 p30 -69.92 -9.78 56.2 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 120.7 -1.25 . . . . 0.0 111.242 172.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.258 2.5 m-80 70.68 34.05 2.16 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 126.949 2.1 . . . . 0.0 111.522 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 29.7 mt-10 -131.27 132.45 44.58 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 126.512 1.925 . . . . 0.0 107.252 172.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . 0.67 HD11 ' HA ' ' A' ' 143' ' ' ILE . 10.3 mm -99.31 112.13 30.74 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 169.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 17.9 p30 -86.11 177.97 7.37 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 122.949 0.5 . . . . 0.0 109.818 176.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 90.0 mt-10 -56.6 -54.36 46.83 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 118.907 -0.568 . . . . 0.0 111.883 -178.141 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -59.45 -45.0 92.83 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.143 0.883 . . . . 0.0 111.817 -176.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 74.7 mt-10 -57.9 -47.1 83.79 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 122.714 0.406 . . . . 0.0 110.36 176.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.8 -53.86 40.33 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.37 -177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 57.9 mt -43.11 -55.15 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.423 1.089 . . . . 0.0 110.248 172.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -53.47 -57.61 10.07 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.131 -0.461 . . . . 0.0 111.123 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 6.1 tt -64.96 -35.28 75.02 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 119.445 -0.902 . . . . 0.0 111.834 -176.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.515 ' CE ' HD13 ' A' ' 168' ' ' LEU . 15.4 mmt -60.14 -43.5 95.67 Favored 'General case' 0 C--O 1.234 0.243 0 O-C-N 121.711 -0.618 . . . . 0.0 110.9 177.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -67.14 -53.63 28.85 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 173.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.1 tttp -42.85 -49.6 5.8 Favored 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.923 1.289 . . . . 0.0 111.575 179.117 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 15.9 m -85.25 -0.53 54.98 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.626 0.771 . . . . 0.0 112.225 -171.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 16.5 m 56.38 35.12 25.36 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.408 -0.807 . . . . 0.0 111.263 -169.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.565 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -78.57 -40.53 34.45 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 169.678 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 . . . . . 0 C--O 1.251 1.144 0 N-CA-C 107.968 -1.123 . . . . 0.0 107.968 169.162 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 22.6 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.689 -0.115 . . . . 0.0 110.689 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.24 -37.46 47.18 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 122.886 0.475 . . . . 0.0 111.528 179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 20.7 mmt180 -55.44 -20.13 11.47 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 113.309 0.855 . . . . 0.0 113.309 178.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -53.1 -38.22 62.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 120.694 1.588 . . . . 0.0 111.189 170.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 70.3 mt -64.15 -11.09 27.05 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.454 0.701 . . . . 0.0 112.352 178.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 19.8 mm -107.61 -54.31 5.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.334 0 C-N-CA 124.92 1.288 . . . . 0.0 108.531 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -47.56 -39.92 17.73 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 126.423 1.889 . . . . 0.0 111.235 175.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' B' ' 249' ' ' HIS . 5.7 p -43.31 -44.4 5.46 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.998 0.919 . . . . 0.0 112.35 172.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.59 -52.36 52.75 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-O 118.813 -0.613 . . . . 0.0 110.187 -179.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 15.1 m95 -50.34 -50.55 50.74 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 119.073 0.852 . . . . 0.0 110.998 177.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.481 ' HA ' HD21 ' A' ' 168' ' ' LEU 0.321 1.8 p-80 -64.36 -45.97 85.45 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.61 179.359 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 16.7 ttt85 -55.26 -52.53 63.1 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-O 117.953 -1.023 . . . . 0.0 112.028 179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 57.7 mt -48.58 -60.92 2.31 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 120.112 1.324 . . . . 0.0 110.869 -175.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 6.4 mt -73.18 -44.61 59.63 Favored 'General case' 0 N--CA 1.456 -0.173 0 O-C-N 122.133 -0.355 . . . . 0.0 110.996 -173.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.565 ' CE1' HD23 ' A' ' 168' ' ' LEU . 10.8 m-30 -66.75 -28.27 68.28 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.149 -0.62 . . . . 0.0 110.661 -177.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.48 -45.97 61.08 Favored 'General case' 0 C--O 1.232 0.182 0 C-N-CA 123.674 0.79 . . . . 0.0 110.36 170.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -73.29 64.75 0.81 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.71 0.804 . . . . 0.0 111.519 -176.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -73.47 71.17 1.3 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.052 0.941 . . . . 0.0 110.005 176.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.092 -1.432 . . . . 0.0 110.821 174.493 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.297 0 N-CA-C 112.176 -0.37 . . . . 0.0 112.176 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.9 p -12.02 -76.03 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 128.394 2.678 . . . . 0.0 113.968 -177.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -126.64 29.47 4.46 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.267 1.413 . . . . 0.0 110.881 173.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -81.24 58.12 3.44 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.68 0.792 . . . . 0.0 110.025 -172.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 70.6 mmt-85 -78.37 49.91 0.89 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.628 0.771 . . . . 0.0 111.309 -175.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -71.6 149.96 45.14 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 1.5 m -39.44 -47.84 1.88 Allowed 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 125.313 1.445 . . . . 0.0 112.387 175.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 41.0 ttp85 -51.54 -51.52 54.6 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.961 0.904 . . . . 0.0 111.415 175.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -64.26 -45.72 86.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -176.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -64.77 -41.84 95.56 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 120.868 0.365 . . . . 0.0 110.432 -177.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 52.5 mt -53.41 -52.72 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 169.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -62.07 -41.85 98.59 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 121.927 -0.483 . . . . 0.0 110.523 -173.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -53.35 -53.77 46.21 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.653 -0.654 . . . . 0.0 110.324 170.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -56.27 -42.57 77.66 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 112.071 0.397 . . . . 0.0 112.071 179.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -54.14 -52.31 61.49 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 123.062 0.545 . . . . 0.0 109.654 175.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 56.6 mmm-85 -61.82 -44.07 97.59 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 119.248 -0.406 . . . . 0.0 111.339 179.033 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.47 -47.3 82.24 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 118.445 0.566 . . . . 0.0 109.703 179.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -62.81 -51.21 67.94 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.557 176.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 61.5 t0 -74.05 64.86 1.06 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.227 1.011 . . . . 0.0 110.806 -175.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -43.16 -49.43 6.44 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.63 1.572 . . . . 0.0 112.033 177.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -71.12 -16.21 62.54 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -176.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 58.56 39.12 25.14 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.25 1.42 . . . . 0.0 109.737 -172.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 1.1 p -76.57 32.74 0.13 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.939 1.296 . . . . 0.0 112.404 -176.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 55.88 -0.35 0.12 Allowed Glycine 0 CA--C 1.537 1.42 0 C-N-CA 125.335 1.445 . . . . 0.0 114.595 -173.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 53.0 p -159.62 145.08 15.67 Favored 'General case' 0 N--CA 1.444 -0.727 0 C-N-CA 127.538 2.335 . . . . 0.0 105.208 -170.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 7.7 mt -82.02 113.67 21.7 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 172.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 35.2 p -93.73 165.57 12.64 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 119.655 1.116 . . . . 0.0 111.24 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.4 tt -46.9 -38.78 4.19 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 C-N-CA 123.302 0.641 . . . . 0.0 111.658 169.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 63.5 mttp -63.96 -47.63 79.66 Favored 'General case' 0 CA--C 1.53 0.201 0 O-C-N 121.92 -0.487 . . . . 0.0 110.272 177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -57.42 -46.57 83.37 Favored 'General case' 0 C--O 1.232 0.145 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 177.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 88.3 mt -58.98 -51.95 67.87 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.88 -0.581 . . . . 0.0 110.539 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 45.7 tpt85 -58.92 -43.48 91.11 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 118.996 0.816 . . . . 0.0 110.94 -178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 18.1 mmm-85 -52.69 -62.39 1.68 Allowed 'General case' 0 CA--C 1.529 0.15 0 CA-C-O 121.107 0.48 . . . . 0.0 110.787 175.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 59.1 t -56.63 -44.84 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-N 116.5 -0.318 . . . . 0.0 110.274 -177.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.41 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -58.48 -52.8 64.11 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.071 0.549 . . . . 0.0 110.234 179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 47.4 tptt -49.03 -53.55 19.68 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 124.637 1.175 . . . . 0.0 110.35 174.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -57.38 -44.6 84.6 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.453 0.701 . . . . 0.0 111.158 -178.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 32.3 mt -66.7 -24.44 66.25 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.435 0.294 . . . . 0.0 111.418 175.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.23 -13.33 31.1 Favored Glycine 0 CA--C 1.531 1.049 0 C-N-CA 125.394 1.473 . . . . 0.0 111.518 -177.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.41 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 15.1 mm-40 -71.63 91.38 1.09 Allowed 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.243 1.017 . . . . 0.0 108.302 -177.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 6.4 m-80 -79.6 70.87 6.17 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 121.583 -0.698 . . . . 0.0 109.66 -179.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.5 mt -76.03 137.39 40.2 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 123.612 0.765 . . . . 0.0 109.971 -175.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 74.7 p -68.55 156.55 37.83 Favored 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -49.1 -39.25 27.41 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 122.856 0.463 . . . . 0.0 110.146 170.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -62.68 -55.36 27.59 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.216 0.607 . . . . 0.0 110.797 178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -53.98 -45.36 71.38 Favored 'General case' 0 C--O 1.233 0.201 0 O-C-N 122.089 -0.382 . . . . 0.0 110.926 178.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 81.6 mt -59.44 -45.25 92.1 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.879 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -62.26 -30.24 70.98 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 119.064 0.847 . . . . 0.0 112.332 177.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -62.93 -53.08 59.59 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 119.248 0.931 . . . . 0.0 109.968 170.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 92.9 mtp -52.72 -51.64 59.58 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.152 0.501 . . . . 0.0 111.109 177.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.6 mm -50.03 -65.17 0.26 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.51 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.72 -33.04 66.12 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.399 0.679 . . . . 0.0 111.926 -172.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -60.66 -37.27 81.01 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 122.858 0.463 . . . . 0.0 111.694 174.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -101.03 -60.57 1.5 Allowed 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 113.061 0.763 . . . . 0.0 113.061 179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -58.2 103.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 126.671 1.988 . . . . 0.0 110.397 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 3.2 ptm180 -65.85 -16.91 64.26 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -169.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 37.1 p30 -114.14 0.63 14.32 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 118.524 0.602 . . . . 0.0 112.461 177.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 32.1 t0 44.74 44.74 7.82 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.584 1.154 . . . . 0.0 113.299 -175.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 37.0 p30 -77.67 -17.69 57.43 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.483 -0.761 . . . . 0.0 111.714 174.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.268 31.2 m-80 103.1 17.8 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 129.489 3.115 . . . . 0.0 112.271 178.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -125.95 123.82 39.4 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.508 1.523 . . . . 0.0 109.269 178.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -90.63 119.77 38.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 N-CA-C 106.791 -1.559 . . . . 0.0 106.791 169.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.96 168.74 12.6 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 118.775 0.716 . . . . 0.0 109.748 172.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.4 mp0 -50.47 -50.43 52.54 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.901 176.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -59.56 -53.38 58.79 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.068 0.849 . . . . 0.0 111.026 -175.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 65.9 mt-10 -53.34 -46.28 69.45 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.163 0.585 . . . . 0.0 110.768 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -61.02 -54.33 46.22 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 116.638 -0.256 . . . . 0.0 110.527 -179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 42.9 mt -44.37 -56.14 0.86 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 124.543 1.137 . . . . 0.0 109.954 171.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 88.0 mtt-85 -54.43 -51.94 63.34 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.505 -179.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.8 tt -66.65 -35.49 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 CA-C-N 119.674 1.125 . . . . 0.0 111.716 -177.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.521 ' CE ' HD13 ' A' ' 168' ' ' LEU . 22.1 mmt -57.98 -39.74 78.95 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.957 -0.464 . . . . 0.0 110.808 174.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -63.7 -58.79 5.79 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -40.58 -55.4 2.34 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.161 1.784 . . . . 0.0 111.725 -174.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.658 ' HB ' HD12 ' A' ' 168' ' ' LEU . 12.6 m -91.72 8.58 36.31 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.297 0.639 . . . . 0.0 111.98 -172.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 17.9 t 59.0 38.55 24.17 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.165 -0.96 . . . . 0.0 111.719 -178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.696 HD23 ' CE1' ' B' ' 253' ' ' PHE . 1.0 OUTLIER -80.5 -37.31 31.93 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 169.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 . . . . . 0 C--O 1.251 1.172 0 CA-C-O 117.707 -1.14 . . . . 0.0 109.414 169.654 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 21.0 pttp . . . . . 0 N--CA 1.475 0.781 0 N-CA-C 110.695 -0.113 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -74.52 76.48 1.96 Allowed 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 43.1 mtm180 -36.0 -46.18 0.47 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.956 2.102 . . . . 0.0 111.919 -178.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -32.34 -52.17 0.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 127.135 2.174 . . . . 0.0 112.549 173.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 88.9 mt -57.71 -39.23 76.75 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.02 0.528 . . . . 0.0 111.423 -176.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 71.0 mt -81.14 -46.01 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 -178.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -50.38 -40.13 48.77 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.206 1.002 . . . . 0.0 111.437 175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 62.4 m -50.1 -29.03 8.15 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.719 0.808 . . . . 0.0 112.75 175.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 88.0 mttt -68.56 -52.12 35.24 Favored 'General case' 0 N--CA 1.452 -0.352 0 O-C-N 121.479 -0.763 . . . . 0.0 109.912 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 92.2 m95 -55.43 -45.8 76.74 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.999 0.818 . . . . 0.0 110.743 175.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -48.36 -60.94 2.27 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 123.73 0.812 . . . . 0.0 110.331 173.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 22.2 tpt180 -51.05 -57.15 9.39 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 122.992 0.517 . . . . 0.0 110.75 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -48.68 -59.33 3.62 Favored 'General case' 0 CA--C 1.521 -0.135 0 C-N-CA 124.676 1.19 . . . . 0.0 109.468 -172.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 1.3 tp -72.32 -55.7 6.7 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.982 -174.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.696 ' CE1' HD23 ' A' ' 168' ' ' LEU . 15.4 m-30 -65.13 -17.18 64.25 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 119.041 -0.504 . . . . 0.0 112.07 -169.864 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -48.44 -29.36 3.99 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 118.96 0.8 . . . . 0.0 110.914 169.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.5 -21.94 18.91 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 176.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -56.14 132.96 51.76 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.016 0.825 . . . . 0.0 111.358 -177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.25 -1.357 . . . . 0.0 109.332 -177.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.291 0 N-CA-C 111.71 -0.556 . . . . 0.0 111.71 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.1 t 59.91 -152.73 0.39 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.669 0.788 . . . . 0.0 110.156 -173.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 74.95 -65.76 2.21 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.295 -1.122 . . . . 0.0 110.295 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -75.04 61.92 1.11 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.247 1.019 . . . . 0.0 109.707 176.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -76.22 67.48 2.49 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.794 0.837 . . . . 0.0 108.887 179.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -78.19 58.69 2.1 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 121.546 -0.721 . . . . 0.0 109.657 176.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 58.4 m -47.27 -38.45 12.47 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.638 1.175 . . . . 0.0 110.896 177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 30.2 ttp-105 -41.83 -51.15 4.32 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.081 1.353 . . . . 0.0 111.192 174.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 97.7 mt-10 -69.35 -44.75 70.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 O-C-N 122.025 -0.422 . . . . 0.0 109.885 -173.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -59.37 -49.13 78.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.674 0.749 . . . . 0.0 109.868 179.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 72.9 mt -51.4 -51.73 23.16 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.602 1.161 . . . . 0.0 109.341 172.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -66.68 -37.62 85.12 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 122.037 -0.414 . . . . 0.0 111.191 -173.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -56.39 -54.46 45.31 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.27 -0.894 . . . . 0.0 110.088 169.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.4 -40.27 81.95 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 122.301 -0.249 . . . . 0.0 111.623 179.81 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -56.01 -53.81 52.44 Favored 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 124.038 0.935 . . . . 0.0 109.442 176.5 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 83.6 mtm180 -56.52 -51.63 67.79 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 119.488 -0.292 . . . . 0.0 111.037 177.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.85 -42.81 90.22 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 118.04 0.382 . . . . 0.0 110.448 -177.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -63.77 -45.18 90.94 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.311 -0.376 . . . . 0.0 111.072 176.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 52.7 t0 -75.08 59.94 0.99 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.321 0.648 . . . . 0.0 110.459 179.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -54.46 -38.61 66.57 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.588 1.155 . . . . 0.0 111.359 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -68.81 -15.89 63.63 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 178.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.14 44.36 25.3 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.224 1.01 . . . . 0.0 109.635 -172.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.27 5.19 17.91 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.562 0.745 . . . . 0.0 111.826 178.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 83.91 -46.34 3.64 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 -179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 39.5 p -106.77 160.58 15.37 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 125.407 1.483 . . . . 0.0 108.149 169.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -86.46 133.02 30.82 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 N-CA-C 106.085 -1.82 . . . . 0.0 106.085 169.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.6 p -115.99 167.83 10.62 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.782 0.719 . . . . 0.0 110.74 178.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.9 tt -46.75 -40.96 4.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.558 172.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -59.72 -51.83 68.11 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 122.742 0.417 . . . . 0.0 109.898 176.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -55.83 -49.76 72.4 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 109.781 -0.452 . . . . 0.0 109.781 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 79.8 mt -55.46 -46.96 76.76 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 119.423 -0.322 . . . . 0.0 110.253 179.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 20.1 tpt180 -56.37 -47.16 79.44 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.618 175.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -54.0 -54.82 33.84 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.378 0.99 . . . . 0.0 110.526 178.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 87.6 t -53.6 -52.61 31.98 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 121.435 0.635 . . . . 0.0 109.406 -179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -52.83 -54.37 35.27 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.671 0.788 . . . . 0.0 110.248 -179.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 10.9 mmmm -55.76 -46.4 77.88 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 124.63 1.172 . . . . 0.0 112.286 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -54.84 -38.66 67.69 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.852 0.751 . . . . 0.0 110.701 176.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 44.1 mt -90.46 10.75 23.99 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.376 0.67 . . . . 0.0 112.296 176.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 92.57 -26.25 14.87 Favored Glycine 0 CA--C 1.533 1.166 0 C-N-CA 126.304 1.907 . . . . 0.0 113.663 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -69.78 106.33 3.07 Favored 'General case' 0 N--CA 1.449 -0.481 0 O-C-N 121.783 -0.834 . . . . 0.0 110.091 -170.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -78.52 68.74 4.58 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 86.2 mt -67.5 121.38 15.7 Favored 'General case' 0 C--O 1.232 0.133 0 N-CA-C 108.971 -0.752 . . . . 0.0 108.971 -178.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 71.9 p -67.29 159.26 29.61 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 123.011 0.524 . . . . 0.0 109.604 -177.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -51.59 -36.11 44.15 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.157 0.583 . . . . 0.0 110.356 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -64.87 -56.53 12.82 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.056 0.543 . . . . 0.0 110.962 176.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -52.39 -49.35 64.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.278 0.561 . . . . 0.0 110.375 178.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 97.4 mt -57.02 -47.28 81.28 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.253 175.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 67.7 mt-30 -59.62 -33.51 71.59 Favored 'General case' 0 N--CA 1.456 -0.161 0 O-C-N 121.448 -0.782 . . . . 0.0 112.642 178.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -59.63 -50.84 72.3 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.222 0.919 . . . . 0.0 110.227 172.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 84.0 mtp -56.76 -49.88 73.95 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 122.761 0.425 . . . . 0.0 110.483 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 7.3 mm -51.06 -57.12 3.19 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 C-N-CA 124.568 1.147 . . . . 0.0 108.601 176.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -60.87 -38.68 86.44 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.041 0.537 . . . . 0.0 111.352 -175.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 17.0 tp10 -63.88 -42.64 97.46 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 122.964 0.506 . . . . 0.0 111.715 177.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.81 -43.96 12.87 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -174.574 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 66.7 t0 -76.92 104.93 7.68 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.149 1.379 . . . . 0.0 109.607 -170.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.9 ptm180 -86.23 -7.13 58.76 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.043 -0.503 . . . . 0.0 112.351 -179.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 3.2 p30 -102.97 -28.47 12.0 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.235 0.614 . . . . 0.0 112.212 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 30.5 t0 75.55 38.18 0.4 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 127.571 2.348 . . . . 0.0 113.65 175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 35.2 p-10 -95.96 -0.78 50.26 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.668 0.787 . . . . 0.0 112.345 169.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.277 0.0 OUTLIER 79.3 12.8 1.21 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.835 2.054 . . . . 0.0 113.382 -176.87 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -116.21 143.11 45.94 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 123.929 0.891 . . . . 0.0 108.966 178.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 5.0 mm -103.62 111.81 34.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 N-CA-C 107.147 -1.427 . . . . 0.0 107.147 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -86.62 176.4 7.81 Favored 'General case' 0 CA--C 1.531 0.238 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 173.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -54.19 -47.94 71.5 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.836 -0.602 . . . . 0.0 111.745 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -56.8 -52.79 63.69 Favored 'General case' 0 C--O 1.225 -0.189 0 CA-C-N 119.165 0.893 . . . . 0.0 111.246 179.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 60.4 mt-10 -58.41 -42.99 88.42 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 122.873 0.469 . . . . 0.0 111.016 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -65.35 -51.93 57.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 -179.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -47.79 -51.65 7.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 123.886 0.874 . . . . 0.0 110.22 172.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 59.7 ttt85 -52.64 -59.77 4.06 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.898 0.879 . . . . 0.0 110.072 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 4.1 tt -64.65 -38.1 81.79 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.908 -176.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.426 ' CE ' HD13 ' A' ' 168' ' ' LEU . 0.0 OUTLIER -51.97 -42.3 62.81 Favored 'General case' 0 N--CA 1.453 -0.28 0 CA-C-O 119.133 -0.46 . . . . 0.0 111.498 172.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -66.42 -59.8 3.34 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.857 -0.592 . . . . 0.0 111.013 170.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -43.12 -54.43 4.42 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 123.841 0.856 . . . . 0.0 111.326 -174.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 8.2 m -85.46 6.33 27.28 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.74 0.816 . . . . 0.0 112.375 -170.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.0 m 57.13 31.76 20.54 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 119.554 1.07 . . . . 0.0 111.693 -172.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.673 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.05 -32.65 61.58 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 123.244 0.618 . . . . 0.0 109.974 176.513 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 51.5 m-85 . . . . . 0 C--O 1.255 1.374 0 CA-C-O 117.31 -1.329 . . . . 0.0 109.704 168.511 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 120.174 0.035 . . . . 0.0 111.04 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -70.75 79.06 0.61 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.941 0.896 . . . . 0.0 109.273 176.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . 0.429 ' NE ' ' H ' ' B' ' 241' ' ' ARG . 0.1 OUTLIER -55.29 -20.76 12.17 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.569 1.147 . . . . 0.0 113.341 -174.878 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 47.5 mp0 -45.98 -43.3 14.05 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.079 0.951 . . . . 0.0 110.414 170.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 89.5 mt -56.98 -36.5 70.41 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 122.889 0.476 . . . . 0.0 111.119 178.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 25.9 mt -73.56 -53.56 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.255 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -48.03 -44.07 30.73 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.007 0.923 . . . . 0.0 110.363 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 59.4 m -50.07 -38.28 37.5 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.062 0.945 . . . . 0.0 112.667 177.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -64.41 -56.28 15.32 Favored 'General case' 0 C--N 1.34 0.183 0 CA-C-N 119.356 0.98 . . . . 0.0 109.75 178.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -49.95 -51.29 42.36 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 118.184 0.447 . . . . 0.0 110.334 177.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -48.48 -54.48 14.1 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.902 0.881 . . . . 0.0 110.553 173.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.21 -26.64 60.38 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.829 0.852 . . . . 0.0 112.692 -169.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.4 mt -76.94 -49.41 15.61 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 119.897 1.226 . . . . 0.0 109.869 171.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . 0.573 HD13 HD22 ' A' ' 168' ' ' LEU . 0.6 OUTLIER -70.99 -51.79 23.47 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 120.764 0.316 . . . . 0.0 111.586 -169.238 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.673 ' CE1' HD23 ' A' ' 168' ' ' LEU . 9.0 m-30 -74.25 46.12 0.24 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 123.755 0.822 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -164.57 88.41 0.49 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.044 0.938 . . . . 0.0 109.091 -170.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.76 146.24 17.54 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 169.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -76.04 63.2 1.75 Allowed 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.558 0.743 . . . . 0.0 110.546 178.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 98.0 mttt . . . . . 0 C--O 1.251 1.168 0 CA-C-O 117.295 -1.336 . . . . 0.0 110.283 175.377 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.023 0 N-CA-C 110.748 -0.941 . . . . 0.0 110.748 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.8 m -75.15 73.96 2.29 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.2 0.6 . . . . 0.0 110.996 -177.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 58.19 -112.38 3.87 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.319 1.437 . . . . 0.0 111.274 172.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -53.36 -36.55 61.5 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.344 0.658 . . . . 0.0 110.46 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 5.0 mtt85 -78.08 72.85 4.63 Favored 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -53.05 155.86 2.35 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.354 1.062 . . . . 0.0 110.477 175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 4.2 p -44.87 -49.22 11.04 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.051 0.941 . . . . 0.0 110.999 176.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 69.4 ttt180 -60.02 -40.98 91.17 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.257 0.48 . . . . 0.0 111.557 178.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -62.22 -46.09 90.44 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.144 0.883 . . . . 0.0 109.997 178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -60.51 -49.72 76.43 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.192 0.52 . . . . 0.0 110.168 179.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 55.3 mt -51.53 -47.49 36.61 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.228 0 C-N-CA 123.999 0.919 . . . . 0.0 110.277 173.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -67.99 -42.3 81.0 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.985 -0.447 . . . . 0.0 110.089 -173.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -55.63 -50.28 70.59 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.534 -0.729 . . . . 0.0 110.451 170.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -55.69 -43.75 76.71 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 112.131 0.419 . . . . 0.0 112.131 175.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -55.01 -53.25 58.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 124.126 0.97 . . . . 0.0 109.654 177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 57.7 mmm-85 -61.86 -46.11 90.86 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 119.137 -0.459 . . . . 0.0 111.25 179.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -43.11 87.16 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.784 0.72 . . . . 0.0 109.998 179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 8.6 m-30 -62.21 -48.03 81.81 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.356 175.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -74.04 61.34 0.82 Allowed 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.492 0.717 . . . . 0.0 111.197 -178.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -49.58 -46.79 49.42 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.958 1.703 . . . . 0.0 111.917 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -76.16 -4.63 42.7 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.938 0.718 . . . . 0.0 112.938 -178.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 55.27 49.54 16.92 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.04 1.336 . . . . 0.0 111.591 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 75.0 m -70.59 -19.78 62.82 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.809 -0.557 . . . . 0.0 111.749 171.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.75 -7.12 77.26 Favored Glycine 0 CA--C 1.532 1.101 0 N-CA-C 110.567 -1.013 . . . . 0.0 110.567 -169.609 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 56.0 p -139.5 152.41 46.94 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.282 1.833 . . . . 0.0 106.169 175.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 11.0 mt -85.59 116.02 28.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 44.9 p -96.21 166.48 11.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.811 -178.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 3.0 tt -50.05 -40.62 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.901 169.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -60.9 -48.82 80.06 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 122.031 -0.418 . . . . 0.0 109.961 177.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -55.95 -50.17 71.51 Favored 'General case' 0 C--N 1.339 0.116 0 N-CA-C 110.052 -0.351 . . . . 0.0 110.052 177.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.44 -47.32 84.37 Favored 'General case' 0 CA--C 1.529 0.164 0 O-C-N 122.259 -0.276 . . . . 0.0 110.538 -179.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 44.2 tpt85 -57.86 -47.59 82.28 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.267 0.485 . . . . 0.0 110.242 178.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 3.2 tpt85 -54.38 -56.98 13.14 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.37 0.668 . . . . 0.0 110.677 177.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 55.7 t -50.35 -53.44 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.121 0 C-N-CA 124.23 1.012 . . . . 0.0 110.238 177.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -62.14 -46.65 88.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 122.102 -0.374 . . . . 0.0 110.092 -175.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -54.06 -42.41 69.21 Favored 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.41 1.084 . . . . 0.0 111.25 177.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -56.32 -33.9 66.03 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.507 0.594 . . . . 0.0 111.875 176.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 39.8 mt -86.67 2.63 47.83 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.137 0.575 . . . . 0.0 111.518 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 80.04 -5.89 61.23 Favored Glycine 0 CA--C 1.531 1.078 0 C-N-CA 124.211 0.91 . . . . 0.0 112.263 -172.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -75.74 89.69 2.84 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -82.96 70.44 9.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 81.8 mt -67.44 134.92 52.28 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.716 -177.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 75.8 p -68.57 158.38 34.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 122.799 0.44 . . . . 0.0 110.367 178.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -50.13 -42.23 50.28 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 122.937 0.495 . . . . 0.0 110.121 173.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 37.3 mp0 -60.36 -56.47 21.05 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.708 0.803 . . . . 0.0 110.503 178.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -51.37 -48.94 62.36 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-O 121.048 0.451 . . . . 0.0 110.616 177.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 84.7 mt -58.72 -44.14 90.34 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 119.501 -0.285 . . . . 0.0 111.145 176.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -64.09 -29.33 70.47 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-N 119.017 0.826 . . . . 0.0 112.346 178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -63.08 -53.09 59.03 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 119.346 0.975 . . . . 0.0 109.954 170.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 93.4 mtp -52.64 -52.44 55.61 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.318 0.58 . . . . 0.0 110.377 177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 2.8 mm -50.97 -63.77 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.598 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 176.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -57.13 -34.68 68.62 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 123.551 0.74 . . . . 0.0 111.789 -171.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -56.57 -45.44 81.3 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.235 -0.291 . . . . 0.0 111.208 172.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -85.01 -59.98 2.18 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.056 0.542 . . . . 0.0 112.201 -178.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -71.89 102.41 2.89 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.396 1.878 . . . . 0.0 111.4 -170.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 5.4 ptt180 -62.76 -19.41 63.95 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -175.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 36.1 p30 -111.18 0.38 16.79 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.085 0.857 . . . . 0.0 112.48 178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 25.9 t70 44.61 35.58 1.45 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 125.303 1.441 . . . . 0.0 114.44 -175.313 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 42.1 p30 -69.49 -5.89 27.04 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 120.655 -1.278 . . . . 0.0 111.365 170.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . 0.256 2.0 m-80 77.03 28.95 0.61 Allowed 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 127.635 2.374 . . . . 0.0 111.44 177.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -126.2 138.52 53.65 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.982 1.713 . . . . 0.0 109.111 170.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 8.2 mm -103.18 120.73 53.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.178 0 N-CA-C 107.269 -1.382 . . . . 0.0 107.269 169.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -88.55 169.31 11.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.361 0.664 . . . . 0.0 109.734 172.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -51.01 -54.62 22.89 Favored 'General case' 0 C--O 1.223 -0.312 0 CA-C-O 119.497 -0.287 . . . . 0.0 111.415 -178.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -54.95 -50.76 68.11 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 122.515 0.326 . . . . 0.0 111.32 -175.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 70.9 mt-10 -57.27 -45.78 83.71 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 122.886 0.474 . . . . 0.0 110.879 177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -62.7 -51.41 67.29 Favored 'General case' 0 N--CA 1.454 -0.258 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 -178.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 60.2 mt -48.56 -51.4 11.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.468 0 C-N-CA 124.381 1.072 . . . . 0.0 109.94 173.728 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -50.86 -59.1 4.48 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.855 0.862 . . . . 0.0 110.28 178.178 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 5.4 tt -66.12 -38.34 81.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 O-C-N 121.464 -0.773 . . . . 0.0 112.125 -175.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.493 ' CE ' HD13 ' A' ' 168' ' ' LEU . 14.7 mmt -56.02 -43.82 78.14 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 122.775 0.43 . . . . 0.0 110.264 176.65 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -61.53 -58.01 9.84 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 118.675 -0.678 . . . . 0.0 111.07 172.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.4 mtmt -46.89 -47.39 21.46 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 118.854 0.752 . . . . 0.0 111.035 -178.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . 0.442 ' CG2' HD12 ' A' ' 168' ' ' LEU . 8.2 m -84.34 -3.31 58.2 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-N 114.792 -1.095 . . . . 0.0 111.631 -171.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 9.0 m 53.6 36.51 23.69 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.183 0.902 . . . . 0.0 111.417 -173.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.622 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.4 OUTLIER -75.77 -30.02 59.0 Favored 'General case' 0 CA--C 1.53 0.191 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 173.392 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 . . . . . 0 C--O 1.251 1.155 0 C-N-CA 126.002 1.721 . . . . 0.0 108.1 169.309 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 120.427 0.156 . . . . 0.0 110.783 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 40.5 mttp -55.51 120.11 6.68 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 169.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -77.93 68.97 4.09 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 172.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -41.1 -48.27 3.31 Favored 'General case' 0 C--O 1.226 -0.156 0 C-N-CA 126.254 1.821 . . . . 0.0 112.11 -172.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 85.9 mt -45.89 -46.72 16.06 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.76 0.824 . . . . 0.0 112.1 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 78.6 mt -88.13 -49.22 14.58 Favored 'Isoleucine or valine' 0 C--O 1.231 0.097 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 65.1 mt-10 -58.15 -25.92 62.07 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -174.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 58.7 m -46.47 -35.42 5.61 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.985 0.914 . . . . 0.0 111.891 169.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -73.26 -51.12 18.78 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 122.017 -0.427 . . . . 0.0 110.14 -177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -55.26 -44.96 76.08 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.878 -0.514 . . . . 0.0 110.507 174.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . 0.426 ' CE1' HG22 ' A' ' 166' ' ' THR . 79.2 m-70 -52.66 -61.22 2.42 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.334 0.654 . . . . 0.0 110.189 172.14 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 19.6 tpp85 -44.96 -54.98 5.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.289 1.036 . . . . 0.0 111.028 -176.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 62.3 mt -56.89 -64.26 0.94 Allowed 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 121.337 0.589 . . . . 0.0 110.612 -171.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 5.0 mt -68.57 -43.25 76.96 Favored 'General case' 0 CA--C 1.514 -0.411 0 O-C-N 121.852 -0.53 . . . . 0.0 111.237 -173.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.622 ' CE1' HD23 ' A' ' 168' ' ' LEU . 12.0 m-30 -64.58 -34.81 79.13 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.69 -0.804 . . . . 0.0 109.934 -178.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -63.32 -44.97 93.41 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 118.565 0.621 . . . . 0.0 110.629 169.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -57.3 -47.82 80.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 118.565 0.62 . . . . 0.0 110.747 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -62.34 -47.16 85.44 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.954 0.901 . . . . 0.0 110.147 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 51.4 tttm . . . . . 0 C--O 1.252 1.193 0 CA-C-O 116.649 -1.643 . . . . 0.0 110.115 -176.802 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 1.281 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 46.1 m -74.71 66.73 1.5 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.78 0.832 . . . . 0.0 110.372 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 67.78 20.18 72.08 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.443 0.545 . . . . 0.0 111.954 -171.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.88 64.8 8.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 124.773 1.229 . . . . 0.0 109.984 -174.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 7.4 mmp_? 48.96 35.22 6.41 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 125.651 1.58 . . . . 0.0 113.404 171.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -70.48 148.37 48.37 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 171.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -31.15 -51.79 0.18 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 126.501 1.92 . . . . 0.0 112.252 170.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ARG . . . . . . . . . . . . . 62.1 ttp85 -52.62 -47.03 67.27 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.366 0.667 . . . . 0.0 111.986 -179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -63.32 -47.11 83.59 Favored 'General case' 0 C--N 1.339 0.109 0 O-C-N 121.615 -0.678 . . . . 0.0 109.819 179.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -62.72 -45.5 92.47 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.029 0.442 . . . . 0.0 110.087 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 64.3 mt -50.95 -53.85 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 124.098 0.959 . . . . 0.0 109.736 169.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -64.04 -43.36 95.81 Favored 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.959 -0.463 . . . . 0.0 110.657 -172.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -54.19 -52.27 61.76 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.769 -0.582 . . . . 0.0 110.295 171.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -57.25 -42.03 80.76 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.193 0.452 . . . . 0.0 112.067 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -54.49 -53.22 57.26 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.686 0.794 . . . . 0.0 109.267 177.137 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . . . . . . . . . 43.9 mtm105 -63.65 -44.86 92.6 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 119.064 -0.493 . . . . 0.0 111.687 179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.11 -44.84 83.63 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 118.828 0.74 . . . . 0.0 109.701 179.589 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -64.82 -52.08 58.66 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 119.507 -0.282 . . . . 0.0 111.2 176.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -74.15 65.97 1.2 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.354 0.662 . . . . 0.0 110.222 -178.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -46.47 -46.97 19.31 Favored 'General case' 0 CA--C 1.528 0.132 0 C-N-CA 125.125 1.37 . . . . 0.0 111.65 177.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -65.51 -21.02 66.58 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 112.038 0.385 . . . . 0.0 112.038 -178.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.43 46.3 21.04 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.315 1.446 . . . . 0.0 109.682 -170.856 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 2.6 m -65.2 -21.81 66.81 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.74 0.416 . . . . 0.0 111.39 174.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 92.98 0.37 68.49 Favored Glycine 0 CA--C 1.532 1.112 0 N-CA-C 110.511 -1.036 . . . . 0.0 110.511 -169.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' THR . . . . . . . . . . . . . 40.3 p -145.68 144.76 30.59 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 174.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 14.3 mt -81.94 110.54 17.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 105.943 -1.873 . . . . 0.0 105.943 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.8 p -89.69 163.97 14.89 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 118.709 0.686 . . . . 0.0 111.166 -178.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 2.7 tt -49.12 -38.98 11.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 123.639 0.776 . . . . 0.0 111.412 170.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -62.94 -47.94 81.08 Favored 'General case' 0 C--O 1.233 0.212 0 O-C-N 122.014 -0.429 . . . . 0.0 110.087 176.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -57.11 -50.65 72.15 Favored 'General case' 0 CA--C 1.529 0.161 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 177.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 77.6 mt -58.19 -47.18 84.24 Favored 'General case' 0 N--CA 1.457 -0.089 0 O-C-N 122.048 -0.407 . . . . 0.0 110.734 -179.642 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ARG . . . . . . . . . . . . . 27.9 tpt85 -55.95 -46.31 78.58 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.3 0.5 . . . . 0.0 109.934 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -55.51 -55.1 35.79 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.977 0.353 . . . . 0.0 110.719 176.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 66.2 t -49.2 -52.08 11.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 121.296 0.569 . . . . 0.0 109.648 177.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.522 ' HB1' ' O ' ' A' ' 132' ' ' GLU . . . -56.94 -52.55 64.76 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.039 0.936 . . . . 0.0 110.442 -177.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -51.8 -50.64 60.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.449 0.699 . . . . 0.0 111.917 173.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -57.07 -45.26 83.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.402 0.546 . . . . 0.0 110.852 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 87.7 mt -67.57 -25.47 65.81 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 122.31 -0.244 . . . . 0.0 111.575 175.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLY . . . . . . . . . . . . . . . 110.3 -31.94 7.03 Favored Glycine 0 CA--C 1.529 0.933 0 C-N-CA 126.087 1.803 . . . . 0.0 110.792 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.522 ' O ' ' HB1' ' A' ' 127' ' ' ALA . 4.9 mm-40 -65.2 92.46 0.12 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.877 1.271 . . . . 0.0 109.422 -176.424 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -74.65 83.84 2.08 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 121.352 -0.843 . . . . 0.0 110.811 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 64.1 mt -71.2 131.51 43.63 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 123.854 0.861 . . . . 0.0 109.148 178.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 23.0 p -72.99 161.74 30.32 Favored 'General case' 0 N--CA 1.455 -0.197 0 CA-C-N 118.385 0.539 . . . . 0.0 110.241 -179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -48.76 -42.55 35.86 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.082 0.553 . . . . 0.0 110.272 173.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.415 ' CD ' ' H ' ' A' ' 137' ' ' GLU . 2.4 mp0 -58.98 -56.67 19.32 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.13 0.572 . . . . 0.0 110.309 178.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -50.7 -50.0 56.13 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.02 0.438 . . . . 0.0 109.93 178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 82.4 mt -58.07 -46.68 85.04 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.027 177.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLN . . . . . . . . . . . . . 70.9 mt-30 -64.02 -31.99 73.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.338 0.972 . . . . 0.0 112.197 179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -62.98 -49.3 75.25 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.402 1.001 . . . . 0.0 110.019 172.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' MET . . . . . . . . . . . . . 66.1 mtp -55.15 -52.12 64.3 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.04 0.536 . . . . 0.0 110.884 177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 3.4 mm -50.03 -63.07 0.43 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.462 0 C-N-CA 124.558 1.143 . . . . 0.0 108.375 175.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -56.55 -38.15 71.52 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.415 1.086 . . . . 0.0 111.597 -172.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 22.0 tp10 -57.31 -39.8 76.56 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.966 0.507 . . . . 0.0 111.606 175.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ALA . . . . . . . . . . . . . . . -90.66 -36.42 14.38 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -177.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -75.75 116.72 16.75 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.224 1.409 . . . . 0.0 110.94 -169.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' ARG . . . . . . . . . . . . . 48.9 ptt85 -109.09 -3.26 17.51 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.135 0.974 . . . . 0.0 111.976 172.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -100.03 -28.36 13.1 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 123.477 0.711 . . . . 0.0 111.52 -175.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 82.89 29.09 0.1 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.442 2.297 . . . . 0.0 113.016 170.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 50.1 p-10 -83.65 -11.66 56.97 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.799 0.84 . . . . 0.0 112.078 169.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 67.62 33.71 4.89 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.284 1.433 . . . . 0.0 111.335 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -132.36 165.84 23.32 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 127.07 2.148 . . . . 0.0 106.194 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' ILE . . . . . . . . . . . . . 1.5 mm -98.48 124.04 51.38 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.142 0 N-CA-C 107.189 -1.411 . . . . 0.0 107.189 169.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -88.81 166.64 13.88 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.709 0.686 . . . . 0.0 109.416 169.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -55.42 -48.6 74.15 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 122.121 -0.362 . . . . 0.0 111.162 -175.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.1 -51.26 70.79 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.259 0.624 . . . . 0.0 110.936 -177.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -53.42 -46.92 69.97 Favored 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 123.45 0.7 . . . . 0.0 110.743 174.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' PHE . . . . . . . . . . . . . 35.9 t80 -61.34 -48.35 81.73 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ILE . . . . . . . . . . . . . 43.3 mt -48.74 -54.26 5.35 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 C-N-CA 123.552 0.741 . . . . 0.0 109.922 172.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ARG . . . . . . . . . . . . . 52.2 mmt-85 -54.67 -56.7 16.35 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 119.136 -0.459 . . . . 0.0 111.721 178.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 8.3 tt -65.6 -37.08 79.15 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.687 -173.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' MET . . . . . 0.476 ' CE ' HD13 ' A' ' 168' ' ' LEU . 12.9 mmt -58.48 -41.55 85.53 Favored 'General case' 0 CA--C 1.533 0.301 0 O-C-N 122.061 -0.399 . . . . 0.0 111.069 177.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -67.19 -56.57 9.35 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.508 0.14 . . . . 0.0 110.636 172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -43.19 -47.38 6.31 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 125.111 1.364 . . . . 0.0 111.401 -179.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' THR . . . . . . . . . . . . . 11.0 m -87.65 0.44 55.67 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 123.897 0.879 . . . . 0.0 112.026 -171.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 15.5 m 56.12 38.26 29.69 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.319 0.963 . . . . 0.0 111.494 -171.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' LEU . . . . . 0.646 HD23 ' CE1' ' B' ' 253' ' ' PHE . 0.6 OUTLIER -84.6 -40.4 17.55 Favored 'General case' 0 CA--C 1.528 0.098 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 169.857 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.74 -1.6 . . . . 0.0 108.608 169.321 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 239' ' ' LYS . . . . . . . . . . . . . 23.4 mtpp . . . . . 0 N--CA 1.477 0.879 0 CA-C-O 121.22 0.533 . . . . 0.0 110.534 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 240' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -53.03 -35.73 59.76 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.291 1.036 . . . . 0.0 112.016 -175.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 241' ' ' ARG . . . . . . . . . . . . . 27.4 mtm105 -58.99 -38.71 79.81 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.647 0.379 . . . . 0.0 111.648 176.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 242' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -85.51 -39.37 17.53 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.631 0.773 . . . . 0.0 109.986 -178.125 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 243' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.87 73.05 1.6 Allowed 'General case' 0 CA--C 1.53 0.204 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 173.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 244' ' ' ILE . . . . . . . . . . . . . 21.8 mm -41.65 -44.94 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 C-N-CA 126.359 1.864 . . . . 0.0 112.979 -169.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 245' ' ' GLU . . . . . . . . . . . . . 20.5 pm0 -39.76 -40.41 0.94 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.308 1.443 . . . . 0.0 112.187 176.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 246' ' ' SER . . . . . . . . . . . . . 15.9 m -47.29 -42.26 20.61 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.997 1.319 . . . . 0.0 112.996 178.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 247' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 -48.32 19.47 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 121.851 -0.531 . . . . 0.0 110.669 -176.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 248' ' ' TRP . . . . . . . . . . . . . 11.4 m95 -56.35 -42.14 77.27 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 117.928 0.331 . . . . 0.0 110.498 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 249' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -52.75 -59.34 4.61 Favored 'General case' 0 N--CA 1.454 -0.259 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 169.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 250' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.36 -49.74 43.03 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 118.928 -0.558 . . . . 0.0 111.982 -176.072 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 251' ' ' LEU . . . . . . . . . . . . . 24.7 mt -57.29 -39.71 76.29 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 118.573 0.624 . . . . 0.0 112.639 -169.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 252' ' ' LEU . . . . . . . . . . . . . 2.1 mt -95.83 -51.05 4.64 Favored 'General case' 0 N--CA 1.462 0.149 0 C-N-CA 122.676 0.39 . . . . 0.0 110.8 -179.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 253' ' ' PHE . . . . . 0.646 ' CE1' HD23 ' A' ' 168' ' ' LEU . 8.2 m-30 -67.37 -37.72 83.63 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 119.303 -0.379 . . . . 0.0 110.706 -174.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 254' ' ' HIS . . . . . . . . . . . . . 17.0 t-80 19.58 73.28 0.02 OUTLIER 'General case' 0 C--N 1.342 0.278 0 C-N-CA 128.391 2.677 . . . . 0.0 114.091 -175.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 255' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -47.02 -33.09 4.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 123.754 0.822 . . . . 0.0 112.818 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . 57.8 mttp -68.83 80.2 0.3 Allowed 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.335 0.654 . . . . 0.0 110.046 176.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 257' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm . . . . . 0 C--O 1.251 1.177 0 C-N-CA 125.929 1.692 . . . . 0.0 108.304 169.747 . . . . . . . . 0 0 . 1 stop_ save_