data_1lo1_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 1lo1 _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 ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . 0.406 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . 0.418 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.418 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . 0.406 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 . . . . . 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 0.1 OUTLIER 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? . . . . . 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' SER . . . . . 0.514 ' HG ' ' HG2' ' A' ' 121' ' ' GLU . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . 0.514 ' HG2' ' HG ' ' A' ' 111' ' ' SER . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . 0.505 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.505 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 . . . . . 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.636 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . 0.636 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' CYS . . . . . 0.419 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' CYS . . . . . 0.419 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.9 tp -142.6 145.18 33.23 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.513 1.525 . . . . 0.0 107.315 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -59.94 161.12 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.413 2.075 . . . . 0.0 112.229 166.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -67.08 105.51 1.69 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 168.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -68.84 141.25 55.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . 0.406 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . 0.418 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.418 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . 0.406 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.012 1 O4'-C1'-N19 113.948 7.685 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 1 O4'-C1'-N19 112.47 5.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 0 O4'-C1'-N19 109.951 2.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C4'-C3' 109.245 3.645 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 1 O4'-C1'-N19 112.304 5.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.543 5.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.7 1 O4'-C1'-N19 116.878 11.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.683 0 O4'-C1'-N19 109.749 2.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 113.728 7.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.132 2.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.543 3.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.23 0 O4'-C1'-N19 110.575 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.638 1 O4'-C1'-N19 114.095 7.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 0 O4'-C1'-N19 110.548 3.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 2 O4'-C1'-N19 111.21 4.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.166 0 O5'-C5'-C4' 113.417 2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.783 1 O4'-C1'-N19 112.459 5.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 1 O4'-C1'-N19 113.524 7.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 1 O4'-C1'-N19 112.4 5.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.588 0 P-O3'-C3' 123.764 3.387 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 113.211 6.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 0 O4'-C1'-N19 110.605 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.826 2 C5'-C4'-C3' 107.5 -4.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 109.791 2.489 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.385 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.37 124.25 79.88 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 168.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.1 139.14 41.73 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.632 2.221 . . . . 0.0 112.232 -167.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -142.38 165.88 26.21 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 127.503 2.321 . . . . 0.0 106.591 166.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -60.28 150.97 28.73 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 169.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.063 1 O4'-C1'-N19 114.103 7.879 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.847 1 O4'-C1'-N19 112.397 5.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.878 1 O4'-C1'-N19 111.669 4.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 112.405 5.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.214 4.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.72 3.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 2 O4'-C1'-N19 114.183 7.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.056 0 O4'-C1'-N19 110.17 2.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 1 O4'-C1'-N19 112.398 5.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.346 1 O4'-C1'-N19 113.755 7.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.321 0 O4'-C1'-N19 110.406 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.78 0 O4'-C1'-N19 110.577 3.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.18 0 O4'-C1'-N19 110.615 3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.63 1 O4'-C1'-N19 114.155 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.802 0 O4'-C1'-N19 110.872 3.84 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 2 O4'-C1'-N19 112.488 5.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.746 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.728 4.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.701 1 O4'-C1'-N19 113.113 6.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 1 O4'-C1'-N19 111.388 4.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 112.168 5.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 2 O4'-C1'-N19 114.745 8.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C1'-N19 109.914 2.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 0 O4'-C1'-N19 109.944 2.68 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.865 1 O4'-C1'-N19 111.083 4.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.435 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.97 163.49 50.74 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.802 1.641 . . . . 0.0 109.115 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -55.47 132.76 54.11 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.014 2.476 . . . . 0.0 111.001 167.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -74.4 -79.65 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 169.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.65 140.26 44.14 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 115.037 9.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.507 3.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.703 3.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.731 1 O4'-C1'-N19 111.957 5.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 113.721 7.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 114.047 2.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.173 6.716 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.658 4.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.556 0 O4'-C4'-C3' 108.459 2.859 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.703 1 O4'-C1'-N19 113.282 6.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 1 O4'-C1'-N19 112.944 6.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.335 4.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.611 3.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.119 1 O4'-C1'-N19 111.556 4.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.413 0 O5'-C5'-C4' 114.239 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 1 O4'-C1'-N19 111.575 4.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.9 0 O5'-C5'-C4' 113.716 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.848 1 O4'-C1'-N19 113.188 6.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C1'-N19 110.986 3.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.859 1 O4'-C1'-N19 111.718 4.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.621 3.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 P-O3'-C3' 123.673 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 113.397 6.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C1'-N19 110.63 3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O5'-C5'-C4' 114.719 3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.07 0 O4'-C1'-N19 110.33 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 40.7 pt -135.16 168.79 15.99 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 126.549 1.94 . . . . 0.0 108.199 169.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -55.12 121.79 10.54 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.614 2.209 . . . . 0.0 109.457 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -148.42 -60.11 0.24 Allowed 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.94 0.896 . . . . 0.0 109.816 -167.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 -59.7 147.42 37.72 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 170.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 1 O4'-C1'-N19 115.103 9.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.906 3.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.662 0 P-O3'-C3' 123.42 3.1 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.947 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 2 O4'-C1'-N19 114.468 8.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C1'-N19 110.727 3.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 2 P-O3'-C3' 127.509 6.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.41 0 O5'-C5'-C4' 114.613 3.152 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.601 0 O4'-C1'-N19 110.715 3.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.983 1 O4'-C1'-N19 111.685 4.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.932 0 O4'-C1'-N19 110.08 2.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.33 0 O4'-C1'-N19 110.718 3.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.246 0 O4'-C1'-N19 110.764 3.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.04 1 O4'-C1'-N19 111.026 4.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 1 O4'-C1'-N19 111.297 4.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.714 1 O4'-C1'-N19 112.868 6.336 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.011 0 O5'-C5'-C4' 113.585 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 O4'-C1'-N19 110.84 3.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.653 0 O4'-C1'-N19 110.331 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.569 0 O4'-C4'-C3' 108.531 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.379 0 O4'-C1'-N19 110.403 3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.598 0 P-O3'-C3' 123.321 3.018 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.488 1 O4'-C1'-N19 113.704 7.38 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.149 0 O4'-C1'-N19 110.248 3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.284 1 O4'-C1'-N19 111.378 4.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 121.082 0.468 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.0 pt -56.79 153.42 22.37 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 123.108 0.563 . . . . 0.0 110.28 168.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -65.8 139.81 58.84 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.206 1.937 . . . . 0.0 109.744 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -135.7 115.6 13.11 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -141.29 37.51 1.71 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.549 1.14 . . . . 0.0 108.466 168.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 0.1 OUTLIER 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.283 0 O4'-C1'-N19 110.936 3.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C1'-N19 110.385 3.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.598 0 P-O3'-C3' 123.448 3.124 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.952 1 O4'-C1'-N19 112.762 6.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 1 O4'-C1'-N19 113.037 6.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 1 O4'-C1'-N19 112.422 5.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 114.697 8.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.898 3.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 113.238 6.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 O4'-C1'-N19 110.919 3.899 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.681 0 O4'-C1'-N19 110.287 3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.435 0 O4'-C1'-N19 110.715 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.915 1 O4'-C1'-N19 111.475 4.593 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.449 1 O4'-C1'-N19 111.595 4.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O4'-C1'-N19 110.377 3.221 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.368 0 O4'-C1'-N19 110.528 3.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 1 O4'-C1'-N19 112.307 5.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.962 1 O4'-C1'-N19 111.073 4.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.29 0 O4'-C1'-N19 110.506 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.57 0 P-O3'-C3' 124.123 3.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 1 O4'-C1'-N19 112.593 5.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 0 P-O3'-C3' 123.186 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.802 0 O4'-C1'-N19 110.303 3.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.25 149.1 88.07 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 122.946 0.498 . . . . 0.0 110.453 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.89 153.93 63.49 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.421 2.081 . . . . 0.0 109.896 167.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -134.07 141.48 47.19 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.66 1.184 . . . . 0.0 108.45 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -69.3 140.91 54.41 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 114.084 7.855 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.985 1 O4'-C1'-N19 112.642 6.052 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.13 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 1 O4'-C1'-N19 114.154 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-N19 110.046 2.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 1 O4'-C1'-N19 114.141 7.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 112.852 6.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.969 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 0 O4'-C1'-N19 110.53 3.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.271 2 O4'-C1'-N19 112.699 6.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.101 2.877 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 0 O4'-C1'-N19 110.741 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 0 P-O3'-C3' 123.027 2.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.258 0 O4'-C1'-N19 110.445 3.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C4'-C3' 108.898 3.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 108.495 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 111.067 4.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.549 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.605 1 O4'-C1'-N19 111.183 4.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 112.027 5.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 1 O4'-C1'-N19 114.342 8.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.956 0 O4'-C1'-N19 110.46 3.325 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.02 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 0 O4'-C1'-N19 110.576 3.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.34 149.24 95.03 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 123.236 0.614 . . . . 0.0 110.855 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.43 150.98 41.96 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.672 2.248 . . . . 0.0 109.818 167.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 129.72 22.39 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.08 1.352 . . . . 0.0 107.591 170.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -79.5 115.18 18.97 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.08 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 P-O3'-C3' 123.5 3.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.988 0 O4'-C1'-N19 110.145 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.982 1 O4'-C1'-N19 111.988 5.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C1'-N19 110.35 3.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 111.834 5.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 1 O4'-C1'-N19 111.224 4.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.582 0 P-O3'-C3' 123.963 3.553 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 1 O4'-C1'-N19 112.858 6.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.013 1 O4'-C1'-N19 112.025 5.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 O4'-C1'-N19 110.559 3.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 0 O4'-C1'-N19 110.533 3.417 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.857 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.844 0 O4'-C1'-N19 110.532 3.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.414 0 P-O3'-C3' 123.807 3.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.495 0 O4'-C1'-N19 110.464 3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.152 0 P-O3'-C3' 123.156 2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.078 2 O4'-C1'-N19 111.827 5.034 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.657 0 O4'-C1'-N19 110.49 3.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.504 0 O4'-C1'-N19 110.418 3.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.348 1 O4'-C1'-N19 111.352 4.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.325 1 O4'-C1'-N19 112.652 6.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 122.702 2.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.698 0 O4'-C1'-N19 110.134 2.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.91 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.02 117.66 43.5 Favored Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 169.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -62.16 149.37 90.78 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.901 2.401 . . . . 0.0 112.17 167.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -56.83 144.89 31.38 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 168.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -64.46 124.08 20.88 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.028 1 O4'-C1'-N19 111.393 4.491 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 0 P-O3'-C3' 123.495 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.48 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.895 0 P-O3'-C3' 123.447 3.122 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.46 1 O4'-C1'-N19 111.458 4.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.541 0 O5'-C5'-C4' 114.373 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.047 2 P-O3'-C3' 127.399 6.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.109 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.864 1 O4'-C1'-N19 111.758 4.948 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.492 1 O4'-C1'-N19 112.705 6.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.48 1 O4'-C1'-N19 112.362 5.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 1 O4'-C1'-N19 112.508 5.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.964 1 O4'-C1'-N19 111.513 4.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.474 0 O5'-C5'-C4' 114.374 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.263 1 O4'-C1'-N19 111.175 4.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.867 0 O4'-C1'-N19 109.571 2.214 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.809 1 O4'-C1'-N19 112.627 6.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.004 1 O4'-C1'-N19 111.818 5.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C4'-C3' 108.505 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.265 0 O4'-C4'-C3' 108.678 3.078 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 P-O3'-C3' 123.699 3.333 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.307 1 O4'-C1'-N19 113.418 7.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.091 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.093 1 O4'-C1'-N19 112.123 5.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.443 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.8 pt -60.93 140.98 93.64 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.187 0.595 . . . . 0.0 110.557 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -59.86 155.26 44.8 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.212 2.608 . . . . 0.0 112.256 166.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -142.23 164.95 28.78 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.838 1.655 . . . . 0.0 108.386 -171.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 -133.02 114.83 14.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.514 ' HG ' ' HG2' ' A' ' 121' ' ' GLU . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . 0.514 ' HG2' ' HG ' ' A' ' 111' ' ' SER . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 1 O4'-C1'-N19 113.833 7.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 1 O4'-C1'-N19 112.383 5.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 1 O4'-C1'-N19 111.536 4.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.396 0 O4'-C1'-N19 109.967 2.709 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.292 1 O4'-C1'-N19 111.158 4.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 1 O4'-C1'-N19 111.815 5.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.205 1 O4'-C1'-N19 112.193 5.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.548 3.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.264 1 O4'-C1'-N19 111.015 4.019 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 1 O4'-C1'-N19 112.507 5.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.527 0 O4'-C1'-N19 110.417 3.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.782 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 0 O4'-C1'-N19 110.725 3.657 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 114.511 8.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 112.24 5.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.408 1 O4'-C1'-N19 111.453 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.67 1 O4'-C1'-N19 111.926 5.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.833 1 O4'-C1'-N19 112.894 6.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.306 1 O4'-C1'-N19 113.161 6.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 1 O4'-C1'-N19 112.828 6.285 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.327 2.727 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.85 0 O4'-C4'-C3' 108.299 2.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.699 1 O4'-C1'-N19 113.408 7.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O4'-C1'-N19 110.122 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.798 0 O4'-C1'-N19 110.694 3.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.441 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 141.97 80.95 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 123.018 0.527 . . . . 0.0 110.279 169.371 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -87.83 170.34 6.31 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.195 2.596 . . . . 0.0 111.559 169.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -65.12 141.8 58.58 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -143.45 -175.51 4.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.338 1.855 . . . . 0.0 107.602 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.934 1 O4'-C1'-N19 114.045 7.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.818 1 O4'-C1'-N19 112.61 6.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C4'-C3' 108.329 2.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.976 0 C4'-C3'-O3' 118.548 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.606 2 P-O3'-C3' 126.602 5.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.786 1 O4'-C1'-N19 112.198 5.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.475 1 O4'-C1'-N19 114.002 7.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.64 0 O4'-C1'-N19 110.948 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.75 0 O4'-C1'-N19 109.794 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 1 O4'-C1'-N19 112.403 5.754 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 1 O4'-C1'-N19 113.335 6.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 1 O4'-C1'-N19 111.68 4.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C1'-N19 110.795 3.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.033 1 O4'-C1'-N19 111.151 4.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.998 0 O4'-C1'-N19 110.024 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.769 1 O4'-C1'-N19 111.328 4.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.242 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 113.224 6.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 1 O4'-C1'-N19 111.481 4.602 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O4'-C4'-C3' 108.463 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.401 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.443 0 P-O3'-C3' 123.462 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 113.604 7.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.614 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 1 O4'-C1'-N19 111.807 5.009 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C1'-N19 110.682 3.603 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 pt -66.32 153.84 91.75 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 123.095 0.558 . . . . 0.0 110.792 169.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -60.18 161.64 19.08 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.956 2.437 . . . . 0.0 112.216 165.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -140.05 133.04 29.4 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 169.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -85.01 70.68 10.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -177.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.972 1 O4'-C1'-N19 114.872 8.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 O4'-C1'-N19 110.546 3.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.36 1 O4'-C1'-N19 112.186 5.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 1 O4'-C1'-N19 113.061 6.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.076 0 O4'-C1'-N19 110.79 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.592 0 O5'-C5'-C4' 115.773 3.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.098 1 O4'-C1'-N19 112.481 5.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.228 0 P-O3'-C3' 124.289 3.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.486 0 O4'-C4'-C3' 108.681 3.081 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 1 O4'-C1'-N19 113.499 7.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C1'-N19 110.226 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.634 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.667 3.584 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 111.221 4.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.827 0 P-O3'-C3' 122.97 2.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 113.199 6.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 111.279 4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.711 1 O4'-C1'-N19 111.368 4.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.586 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C4'-C3' 108.675 3.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 112.584 5.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.003 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 1 O4'-C1'-N19 111.009 4.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C1'-N19 110.34 3.175 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 120.708 0.29 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.9 pt -133.2 159.04 74.19 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 125.702 1.601 . . . . 0.0 109.138 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.2 140.48 44.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.329 2.02 . . . . 0.0 109.725 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -59.61 -59.49 5.36 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -135.87 155.5 50.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.48 1.912 . . . . 0.0 106.074 168.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . 0.505 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.505 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.297 0 O4'-C1'-N19 110.835 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O4'-C1'-N19 110.629 3.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.84 0 O4'-C4'-C3' 108.653 3.053 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 112.816 6.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 114.595 8.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 1 O4'-C1'-N19 111.178 4.222 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.584 1 O4'-C1'-N19 111.538 4.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.622 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.546 0 O4'-C1'-N19 110.264 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.862 1 O4'-C1'-N19 111.647 4.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.57 1 O4'-C1'-N19 112.116 5.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 1 O4'-C1'-N19 112.51 5.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.241 1 O4'-C1'-N19 111.075 4.093 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.78 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 1 O4'-C1'-N19 112.496 5.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 1 O4'-C1'-N19 111.144 4.18 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.147 1 O4'-C1'-N19 112.447 5.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.871 1 O4'-C1'-N19 112.61 6.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C1'-N19 109.661 2.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.941 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.718 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C1'-N19 110.372 3.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.502 0 O4'-C1'-N19 110.14 2.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 P-O3'-C3' 123.427 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 21.0 tt -59.13 139.8 87.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 168.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -71.59 110.18 2.81 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.062 1.841 . . . . 0.0 109.899 169.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -139.28 167.04 22.98 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.383 1.873 . . . . 0.0 107.776 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.6 91.1 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 168.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.359 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 P-O3'-C3' 123.554 3.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.12 1 O4'-C1'-N19 111.779 4.974 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 O4'-C4'-C3' 107.938 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.911 1 O4'-C1'-N19 114.511 8.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.05 0 O4'-C1'-N19 110.847 3.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.894 0 O4'-C1'-N19 110.75 3.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 0 P-O3'-C3' 123.538 3.198 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 1 O4'-C1'-N19 112.804 6.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 O4'-C1'-N19 110.745 3.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 1 O4'-C1'-N19 112.913 6.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.319 1 O4'-C1'-N19 111.012 4.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.676 3.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.031 1 O4'-C1'-N19 111.547 4.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 O4'-C1'-N19 110.535 3.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 2 O4'-C1'-N19 112.442 5.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.151 2.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.57 0 P-O3'-C3' 123.349 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.665 1 O4'-C1'-N19 112.343 5.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 113.158 6.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.625 0 O4'-C4'-C3' 108.098 2.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.71 0 O4'-C4'-C3' 108.796 3.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 113.143 6.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.13 1 O4'-C1'-N19 111.387 4.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.0 pt -131.24 156.43 80.15 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.458 1.503 . . . . 0.0 108.985 169.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -70.98 125.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.386 2.057 . . . . 0.0 108.794 167.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -154.42 170.99 20.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.468 1.507 . . . . 0.0 109.049 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -125.77 102.99 7.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 168.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 1 O4'-C1'-N19 114.357 8.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.986 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.726 0 O4'-C1'-N19 110.22 3.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.395 0 O4'-C4'-C3' 108.897 3.297 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.328 1 O4'-C1'-N19 112.046 5.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 1 O4'-C1'-N19 112.304 5.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.771 0 P-O3'-C3' 123.703 3.335 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.618 0 P-O3'-C3' 122.688 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 113.243 6.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 O4'-C1'-N19 110.085 2.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.744 0 O4'-C1'-N19 110.505 3.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C1'-N19 110.622 3.527 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C1'-N19 110.441 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 2 O4'-C1'-N19 112.568 5.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.136 0 O4'-C4'-C3' 107.677 2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 1 O4'-C1'-N19 113.102 6.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 1 O4'-C1'-N19 113.799 7.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 1 O4'-C1'-N19 111.247 4.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.374 0 O4'-C1'-N19 110.281 3.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.743 0 P-O3'-C3' 123.528 3.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.8 1 O4'-C1'-N19 113.924 7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 2 O4'-C1'-N19 112.627 6.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O4'-C1'-N19 110.792 3.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.781 0 O4'-C1'-N19 110.906 3.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.428 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 43.9 pt -68.03 165.1 35.51 Favored Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 123.382 0.673 . . . . 0.0 110.307 168.609 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -65.37 85.79 0.2 Allowed 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.615 2.21 . . . . 0.0 110.875 165.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -148.96 140.19 23.15 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.309 1.843 . . . . 0.0 106.784 169.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 -66.35 110.59 3.13 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.053 1 O4'-C1'-N19 111.357 4.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.596 0 P-O3'-C3' 123.482 3.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.767 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 1 O4'-C1'-N19 113.437 7.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.191 0 O4'-C1'-N19 110.984 3.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.201 1 O4'-C1'-N19 115.068 9.085 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.008 0 O5'-C5'-C4' 114.394 2.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C4'-C3' 108.693 3.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.498 1 O4'-C1'-N19 113.488 7.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 O4'-C1'-N19 110.205 3.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.795 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.176 1 O4'-C1'-N19 111.37 4.463 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.109 1 O4'-C1'-N19 111.641 4.801 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 1 O4'-C1'-N19 112.974 6.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.648 0 O4'-C1'-N19 110.125 2.907 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 1 O4'-C1'-N19 112.458 5.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 1 O4'-C1'-N19 112.935 6.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.546 0 O4'-C4'-C3' 108.757 3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.204 0 O4'-C1'-N19 110.863 3.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.83 0 P-O3'-C3' 123.479 3.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.378 1 O4'-C1'-N19 113.456 7.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.689 0 O4'-C1'-N19 110.54 3.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.779 0 O4'-C1'-N19 110.706 3.632 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.423 4.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 pt -63.34 154.28 79.19 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.799 0.44 . . . . 0.0 110.237 168.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -70.08 146.0 56.93 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.345 2.03 . . . . 0.0 110.047 168.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.58 102.0 1.75 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 168.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -63.12 127.24 30.33 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.219 1 O4'-C1'-N19 111.36 4.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 P-O3'-C3' 123.47 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.542 0 P-O3'-C3' 123.561 3.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.93 1 O4'-C1'-N19 111.202 4.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.574 2 O4'-C1'-N19 112.488 5.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C1'-N19 110.86 3.825 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.056 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.896 0 O4'-C1'-N19 110.481 3.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.604 1 O4'-C1'-N19 113.471 7.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 1 O4'-C1'-N19 113.767 7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.55 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.002 1 O4'-C1'-N19 111.331 4.413 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.928 0 O4'-C1'-N19 110.051 2.814 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.753 1 O4'-C1'-N19 111.154 4.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.858 0 O4'-C1'-N19 110.839 3.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.723 1 P-O3'-C3' 126.464 5.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.204 6.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 1 O4'-C1'-N19 111.52 4.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 0 O4'-C1'-N19 110.004 2.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.358 0 P-O3'-C3' 124.32 3.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.236 1 O4'-C1'-N19 113.102 6.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.843 0 O4'-C1'-N19 110.258 3.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 0 O4'-C1'-N19 110.429 3.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.403 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.3 pt -66.2 156.13 85.7 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 123.054 0.541 . . . . 0.0 110.31 169.324 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.16 130.26 19.75 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.109 1.873 . . . . 0.0 108.782 167.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.88 156.4 31.06 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 169.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -119.98 43.38 2.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 169.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.253 0 O4'-C1'-N19 110.651 3.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.718 1 O4'-C1'-N19 111.668 4.835 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.422 1 O4'-C1'-N19 111.448 4.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.057 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 1 O4'-C1'-N19 113.053 6.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.758 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 1 O4'-C1'-N19 114.909 8.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.237 2.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.233 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.587 0 P-O3'-C3' 123.573 3.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.994 1 O4'-C1'-N19 113.317 6.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 1 O4'-C1'-N19 111.167 4.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.139 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.982 0 P-O3'-C3' 123.396 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.918 0 O4'-C1'-N19 110.818 3.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 0 O4'-C1'-N19 110.271 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 1 O4'-C1'-N19 112.617 6.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 1 O4'-C1'-N19 111.208 4.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.074 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.668 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.69 0 P-O3'-C3' 123.505 3.171 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.834 1 O4'-C1'-N19 113.395 6.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C1'-N19 110.482 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 1 O4'-C1'-N19 112.214 5.518 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 112.272 5.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.38 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.6 pt -138.79 158.59 69.75 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.531 1.532 . . . . 0.0 109.373 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.67 142.09 43.1 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.512 2.141 . . . . 0.0 109.75 167.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.39 166.5 30.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.581 1.552 . . . . 0.0 109.157 172.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 -127.23 98.87 5.44 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 169.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 115.143 9.179 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.118 0 O4'-C1'-N19 110.752 3.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 0 P-O3'-C3' 123.483 3.153 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 112.162 5.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 112.26 5.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.221 1 O4'-C1'-N19 111.696 4.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 O4'-C1'-N19 114.293 8.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C1'-N19 110.879 3.848 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 1 O4'-C1'-N19 113.131 6.664 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 1 O4'-C1'-N19 113.119 6.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 111.029 4.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.636 3.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O4'-C1'-N19 114.058 7.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.109 1 O4'-C1'-N19 113.434 7.042 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.478 1 O4'-C1'-N19 112.464 5.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.862 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.071 1 O4'-C1'-N19 111.557 4.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 1 O4'-C1'-N19 111.34 4.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.364 0 O4'-C1'-N19 109.583 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.705 1 O4'-C1'-N19 112.262 5.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.431 3.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.007 1 O4'-C1'-N19 112.781 6.226 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 1 O4'-C1'-N19 112.313 5.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.68 152.14 90.67 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 123.407 0.683 . . . . 0.0 110.692 169.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.42 146.99 80.57 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.899 2.399 . . . . 0.0 111.654 166.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.47 152.39 51.31 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.844 1.258 . . . . 0.0 109.774 -175.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.43 123.9 21.27 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -175.192 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.636 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . 0.636 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.27 1 O4'-C1'-N19 111.331 4.414 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O4'-C1'-N19 110.424 3.28 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 0 P-O3'-C3' 123.487 3.155 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 1 O4'-C1'-N19 111.806 5.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 2 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 1 O4'-C1'-N19 112.711 6.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 1 O4'-C1'-N19 113.259 6.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.024 1 P-O3'-C3' 124.901 4.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.989 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C1'-N19 110.241 3.051 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 1 O4'-C1'-N19 113.446 7.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.775 1 O4'-C1'-N19 112.693 6.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.466 1 O4'-C1'-N19 112.596 5.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.164 0 O4'-C1'-N19 110.85 3.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.104 0 P-O3'-C3' 123.167 2.889 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.799 0 O5'-C5'-C4' 114.629 3.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.343 1 O4'-C1'-N19 111.739 4.923 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 P-O3'-C3' 123.939 3.532 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 113.07 6.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C1'-N19 110.075 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.873 0 C4'-C3'-O3' 118.921 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 1 P-O3'-C3' 126.555 5.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 2 O4'-C1'-N19 111.654 4.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.589 3.486 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O4'-C1'-N19 110.481 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.274 3.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 pp -134.4 162.53 57.17 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.953 1.701 . . . . 0.0 109.31 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -55.31 137.6 77.59 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.182 2.588 . . . . 0.0 111.833 168.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.43 146.25 49.02 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 167.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -70.56 90.51 0.75 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 -169.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' CYS . . . . . 0.407 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' CYS . . . . . 0.407 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . 0.415 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.168 1 O4'-C1'-N19 111.359 4.449 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 0 P-O3'-C3' 123.401 3.084 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.611 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.621 1 O4'-C1'-N19 111.646 4.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.806 1 O4'-C1'-N19 111.362 4.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 1 O4'-C1'-N19 111.732 4.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.203 0 C3'-C2'-C1' 106.654 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.783 0 O5'-C5'-C4' 114.324 2.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 0 O4'-C1'-N19 110.379 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.102 1 O4'-C1'-N19 112.721 6.152 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 112.867 6.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.675 3.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C1'-N19 110.662 3.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 111.735 4.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C1'-N19 110.988 3.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.565 2 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.002 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.865 1 O4'-C1'-N19 111.27 4.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 1 O4'-C1'-N19 113.294 6.867 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.461 0 O4'-C4'-C3' 108.664 3.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.78 0 O4'-C1'-N19 110.229 3.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.736 0 O4'-C4'-C3' 108.397 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 1 O4'-C1'-N19 111.05 4.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.851 0 O4'-C1'-N19 110.39 3.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 1 O4'-C1'-N19 111.512 4.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' TYR . . . . . 0.411 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PHE . . . . . 0.451 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 148' ' ' THR . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 184' ' ' LYS . . . . . 0.411 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 . . . . . 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' HIS . . . . . 0.401 ' CD2' ' HE2' ' A' ' 124' ' ' LYS . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.401 ' HE2' ' CD2' ' A' ' 114' ' ' HIS . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 17.0 p-10 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.476 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.476 ' HB2' ' H ' ' A' ' 148' ' ' THR . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 169' ' ' LEU . . . . . 0.438 HD12 ' CE1' ' A' ' 185' ' ' TYR . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' TYR . . . . . 0.438 ' CE1' HD12 ' A' ' 169' ' ' LEU . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? . . . . . 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.417 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.417 ' HB2' ' H ' ' A' ' 148' ' ' THR . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.402 ' HB2' ' H ' ' A' ' 148' ' ' THR . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 182' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 182' ' ' ARG . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' HIS . . . . . 0.516 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.516 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 158' ' ' CYS . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 158' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 155' ' ' CYS . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' CYS . . . . . 0.41 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.415 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.415 ' HB2' ' H ' ' A' ' 148' ' ' THR . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.428 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 148' ' ' THR . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 . . . . . 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' ARG . . . . . 0.422 ' HB2' ' H ' ' A' ' 148' ' ' THR . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 158' ' ' CYS . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 155' ' ' CYS . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.637 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 180' ' ' GLY . . . . . 0.637 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' CYS . . . . . 0.42 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 179' ' ' ARG . . . . . 0.468 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.9 tp -142.6 145.18 33.23 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.513 1.525 . . . . 0.0 107.315 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -59.94 161.12 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.413 2.075 . . . . 0.0 112.229 166.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -67.08 105.51 1.69 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 168.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -68.84 141.25 55.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' TYR . . . . . 0.411 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PHE . . . . . 0.451 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 148' ' ' THR . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.425 ' H ' " H1'" ' B' ' 6' ' ' ' DA' . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 184' ' ' LYS . . . . . 0.411 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.012 1 O4'-C1'-N19 113.948 7.685 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 1 O4'-C1'-N19 112.47 5.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 0 O4'-C1'-N19 109.951 2.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C4'-C3' 109.245 3.645 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 1 O4'-C1'-N19 112.304 5.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . 0.425 " H1'" ' H ' ' A' ' 180' ' ' GLY . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.543 5.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.7 1 O4'-C1'-N19 116.878 11.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.683 0 O4'-C1'-N19 109.749 2.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 113.728 7.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.132 2.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.543 3.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.23 0 O4'-C1'-N19 110.575 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.638 1 O4'-C1'-N19 114.095 7.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 0 O4'-C1'-N19 110.548 3.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 2 O4'-C1'-N19 111.21 4.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.166 0 O5'-C5'-C4' 113.417 2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.783 1 O4'-C1'-N19 112.459 5.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 1 O4'-C1'-N19 113.524 7.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 1 O4'-C1'-N19 112.4 5.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.588 0 P-O3'-C3' 123.764 3.387 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 113.211 6.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 0 O4'-C1'-N19 110.605 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . 0.407 H2'' ' C6 ' ' C' ' 26' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.826 2 C5'-C4'-C3' 107.5 -4.8 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . 0.407 ' C6 ' H2'' ' C' ' 25' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 109.791 2.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.385 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.37 124.25 79.88 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 168.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.1 139.14 41.73 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.632 2.221 . . . . 0.0 112.232 -167.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -142.38 165.88 26.21 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 127.503 2.321 . . . . 0.0 106.591 166.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -60.28 150.97 28.73 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 169.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . 0.4 " H1'" ' C6 ' ' B' ' 2' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.063 1 O4'-C1'-N19 114.103 7.879 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . 0.4 ' C6 ' " H1'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.847 1 O4'-C1'-N19 112.397 5.746 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.878 1 O4'-C1'-N19 111.669 4.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 112.405 5.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.214 4.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.72 3.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 2 O4'-C1'-N19 114.183 7.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.056 0 O4'-C1'-N19 110.17 2.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 1 O4'-C1'-N19 112.398 5.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.346 1 O4'-C1'-N19 113.755 7.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.321 0 O4'-C1'-N19 110.406 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.78 0 O4'-C1'-N19 110.577 3.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.18 0 O4'-C1'-N19 110.615 3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.63 1 O4'-C1'-N19 114.155 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.802 0 O4'-C1'-N19 110.872 3.84 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 2 O4'-C1'-N19 112.488 5.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.746 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.728 4.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.701 1 O4'-C1'-N19 113.113 6.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 1 O4'-C1'-N19 111.388 4.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 112.168 5.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 2 O4'-C1'-N19 114.745 8.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C1'-N19 109.914 2.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 0 O4'-C1'-N19 109.944 2.68 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.865 1 O4'-C1'-N19 111.083 4.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.435 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.97 163.49 50.74 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.802 1.641 . . . . 0.0 109.115 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -55.47 132.76 54.11 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.014 2.476 . . . . 0.0 111.001 167.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -74.4 -79.65 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 169.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.65 140.26 44.14 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 115.037 9.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.507 3.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.703 3.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.731 1 O4'-C1'-N19 111.957 5.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 113.721 7.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 114.047 2.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.173 6.716 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.658 4.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.556 0 O4'-C4'-C3' 108.459 2.859 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.703 1 O4'-C1'-N19 113.282 6.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 1 O4'-C1'-N19 112.944 6.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.335 4.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.611 3.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.119 1 O4'-C1'-N19 111.556 4.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.413 0 O5'-C5'-C4' 114.239 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 1 O4'-C1'-N19 111.575 4.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.9 0 O5'-C5'-C4' 113.716 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.848 1 O4'-C1'-N19 113.188 6.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C1'-N19 110.986 3.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.859 1 O4'-C1'-N19 111.718 4.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.621 3.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 P-O3'-C3' 123.673 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 113.397 6.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C1'-N19 110.63 3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O5'-C5'-C4' 114.719 3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.07 0 O4'-C1'-N19 110.33 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 40.7 pt -135.16 168.79 15.99 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 126.549 1.94 . . . . 0.0 108.199 169.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -55.12 121.79 10.54 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.614 2.209 . . . . 0.0 109.457 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -148.42 -60.11 0.24 Allowed 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.94 0.896 . . . . 0.0 109.816 -167.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 -59.7 147.42 37.72 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 170.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' HIS . . . . . 0.401 ' CD2' ' HE2' ' A' ' 124' ' ' LYS . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.401 ' HE2' ' CD2' ' A' ' 114' ' ' HIS . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 1 O4'-C1'-N19 115.103 9.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.906 3.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.662 0 P-O3'-C3' 123.42 3.1 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.947 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 2 O4'-C1'-N19 114.468 8.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C1'-N19 110.727 3.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 2 P-O3'-C3' 127.509 6.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.41 0 O5'-C5'-C4' 114.613 3.152 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.601 0 O4'-C1'-N19 110.715 3.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.983 1 O4'-C1'-N19 111.685 4.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.932 0 O4'-C1'-N19 110.08 2.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.33 0 O4'-C1'-N19 110.718 3.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.246 0 O4'-C1'-N19 110.764 3.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.04 1 O4'-C1'-N19 111.026 4.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 1 O4'-C1'-N19 111.297 4.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.714 1 O4'-C1'-N19 112.868 6.336 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.011 0 O5'-C5'-C4' 113.585 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 O4'-C1'-N19 110.84 3.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.653 0 O4'-C1'-N19 110.331 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.569 0 O4'-C4'-C3' 108.531 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.379 0 O4'-C1'-N19 110.403 3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.598 0 P-O3'-C3' 123.321 3.018 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.488 1 O4'-C1'-N19 113.704 7.38 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.149 0 O4'-C1'-N19 110.248 3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.284 1 O4'-C1'-N19 111.378 4.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 121.082 0.468 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.0 pt -56.79 153.42 22.37 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 123.108 0.563 . . . . 0.0 110.28 168.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -65.8 139.81 58.84 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.206 1.937 . . . . 0.0 109.744 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -135.7 115.6 13.11 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -141.29 37.51 1.71 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.549 1.14 . . . . 0.0 108.466 168.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 17.0 p-10 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.476 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.476 ' HB2' ' H ' ' A' ' 148' ' ' THR . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.283 0 O4'-C1'-N19 110.936 3.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C1'-N19 110.385 3.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.598 0 P-O3'-C3' 123.448 3.124 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.952 1 O4'-C1'-N19 112.762 6.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 1 O4'-C1'-N19 113.037 6.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 1 O4'-C1'-N19 112.422 5.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 114.697 8.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.898 3.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 113.238 6.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 O4'-C1'-N19 110.919 3.899 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.681 0 O4'-C1'-N19 110.287 3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.435 0 O4'-C1'-N19 110.715 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.915 1 O4'-C1'-N19 111.475 4.593 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.449 1 O4'-C1'-N19 111.595 4.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O4'-C1'-N19 110.377 3.221 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.368 0 O4'-C1'-N19 110.528 3.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 1 O4'-C1'-N19 112.307 5.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.962 1 O4'-C1'-N19 111.073 4.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.29 0 O4'-C1'-N19 110.506 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.57 0 P-O3'-C3' 124.123 3.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 1 O4'-C1'-N19 112.593 5.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 0 P-O3'-C3' 123.186 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.802 0 O4'-C1'-N19 110.303 3.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.25 149.1 88.07 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 122.946 0.498 . . . . 0.0 110.453 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.89 153.93 63.49 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.421 2.081 . . . . 0.0 109.896 167.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -134.07 141.48 47.19 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.66 1.184 . . . . 0.0 108.45 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -69.3 140.91 54.41 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' LEU . . . . . 0.438 HD12 ' CE1' ' A' ' 185' ' ' TYR . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' TYR . . . . . 0.438 ' CE1' HD12 ' A' ' 169' ' ' LEU . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . 0.401 " H1'" ' C6 ' ' B' ' 2' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 114.084 7.855 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . 0.401 ' C6 ' " H1'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 2.985 1 O4'-C1'-N19 112.642 6.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.13 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 1 O4'-C1'-N19 114.154 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-N19 110.046 2.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 1 O4'-C1'-N19 114.141 7.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 112.852 6.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.969 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 0 O4'-C1'-N19 110.53 3.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.271 2 O4'-C1'-N19 112.699 6.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.101 2.877 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 0 O4'-C1'-N19 110.741 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 0 P-O3'-C3' 123.027 2.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.258 0 O4'-C1'-N19 110.445 3.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C4'-C3' 108.898 3.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 108.495 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 111.067 4.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.549 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.605 1 O4'-C1'-N19 111.183 4.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 112.027 5.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 1 O4'-C1'-N19 114.342 8.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.956 0 O4'-C1'-N19 110.46 3.325 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.02 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 0 O4'-C1'-N19 110.576 3.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.34 149.24 95.03 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 123.236 0.614 . . . . 0.0 110.855 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.43 150.98 41.96 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.672 2.248 . . . . 0.0 109.818 167.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 129.72 22.39 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.08 1.352 . . . . 0.0 107.591 170.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -79.5 115.18 18.97 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.08 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 P-O3'-C3' 123.5 3.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.988 0 O4'-C1'-N19 110.145 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.982 1 O4'-C1'-N19 111.988 5.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C1'-N19 110.35 3.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 111.834 5.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 1 O4'-C1'-N19 111.224 4.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.582 0 P-O3'-C3' 123.963 3.553 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 1 O4'-C1'-N19 112.858 6.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.013 1 O4'-C1'-N19 112.025 5.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 O4'-C1'-N19 110.559 3.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 0 O4'-C1'-N19 110.533 3.417 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.857 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.844 0 O4'-C1'-N19 110.532 3.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.414 0 P-O3'-C3' 123.807 3.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.495 0 O4'-C1'-N19 110.464 3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.152 0 P-O3'-C3' 123.156 2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.078 2 O4'-C1'-N19 111.827 5.034 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.657 0 O4'-C1'-N19 110.49 3.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.504 0 O4'-C1'-N19 110.418 3.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.348 1 O4'-C1'-N19 111.352 4.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.325 1 O4'-C1'-N19 112.652 6.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 122.702 2.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.698 0 O4'-C1'-N19 110.134 2.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.91 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.02 117.66 43.5 Favored Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 169.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -62.16 149.37 90.78 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.901 2.401 . . . . 0.0 112.17 167.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -56.83 144.89 31.38 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 168.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -64.46 124.08 20.88 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.028 1 O4'-C1'-N19 111.393 4.491 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 0 P-O3'-C3' 123.495 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.48 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.895 0 P-O3'-C3' 123.447 3.122 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.46 1 O4'-C1'-N19 111.458 4.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.541 0 O5'-C5'-C4' 114.373 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.047 2 P-O3'-C3' 127.399 6.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.109 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.864 1 O4'-C1'-N19 111.758 4.948 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.492 1 O4'-C1'-N19 112.705 6.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.48 1 O4'-C1'-N19 112.362 5.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 1 O4'-C1'-N19 112.508 5.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.964 1 O4'-C1'-N19 111.513 4.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.474 0 O5'-C5'-C4' 114.374 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.263 1 O4'-C1'-N19 111.175 4.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.867 0 O4'-C1'-N19 109.571 2.214 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.809 1 O4'-C1'-N19 112.627 6.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.004 1 O4'-C1'-N19 111.818 5.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C4'-C3' 108.505 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.265 0 O4'-C4'-C3' 108.678 3.078 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 P-O3'-C3' 123.699 3.333 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.307 1 O4'-C1'-N19 113.418 7.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.091 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.093 1 O4'-C1'-N19 112.123 5.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.443 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.8 pt -60.93 140.98 93.64 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.187 0.595 . . . . 0.0 110.557 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -59.86 155.26 44.8 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.212 2.608 . . . . 0.0 112.256 166.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -142.23 164.95 28.78 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.838 1.655 . . . . 0.0 108.386 -171.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 -133.02 114.83 14.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.417 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.417 ' HB2' ' H ' ' A' ' 148' ' ' THR . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 1 O4'-C1'-N19 113.833 7.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 1 O4'-C1'-N19 112.383 5.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 1 O4'-C1'-N19 111.536 4.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.396 0 O4'-C1'-N19 109.967 2.709 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.292 1 O4'-C1'-N19 111.158 4.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 1 O4'-C1'-N19 111.815 5.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.205 1 O4'-C1'-N19 112.193 5.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.548 3.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.264 1 O4'-C1'-N19 111.015 4.019 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 1 O4'-C1'-N19 112.507 5.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.527 0 O4'-C1'-N19 110.417 3.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.782 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 0 O4'-C1'-N19 110.725 3.657 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 114.511 8.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 112.24 5.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.408 1 O4'-C1'-N19 111.453 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.67 1 O4'-C1'-N19 111.926 5.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.833 1 O4'-C1'-N19 112.894 6.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.306 1 O4'-C1'-N19 113.161 6.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 1 O4'-C1'-N19 112.828 6.285 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.327 2.727 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.85 0 O4'-C4'-C3' 108.299 2.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.699 1 O4'-C1'-N19 113.408 7.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O4'-C1'-N19 110.122 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.798 0 O4'-C1'-N19 110.694 3.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.441 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 141.97 80.95 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 123.018 0.527 . . . . 0.0 110.279 169.371 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -87.83 170.34 6.31 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.195 2.596 . . . . 0.0 111.559 169.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -65.12 141.8 58.58 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -143.45 -175.51 4.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.338 1.855 . . . . 0.0 107.602 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.402 ' HB2' ' H ' ' A' ' 148' ' ' THR . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 182' ' ' ARG . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.934 1 O4'-C1'-N19 114.045 7.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.818 1 O4'-C1'-N19 112.61 6.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C4'-C3' 108.329 2.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.976 0 C4'-C3'-O3' 118.548 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.606 2 P-O3'-C3' 126.602 5.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.786 1 O4'-C1'-N19 112.198 5.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.475 1 O4'-C1'-N19 114.002 7.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.64 0 O4'-C1'-N19 110.948 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.75 0 O4'-C1'-N19 109.794 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 1 O4'-C1'-N19 112.403 5.754 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 1 O4'-C1'-N19 113.335 6.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 1 O4'-C1'-N19 111.68 4.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C1'-N19 110.795 3.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.033 1 O4'-C1'-N19 111.151 4.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.998 0 O4'-C1'-N19 110.024 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.769 1 O4'-C1'-N19 111.328 4.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.242 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 113.224 6.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 1 O4'-C1'-N19 111.481 4.602 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O4'-C4'-C3' 108.463 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.401 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.443 0 P-O3'-C3' 123.462 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 113.604 7.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.614 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 1 O4'-C1'-N19 111.807 5.009 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C1'-N19 110.682 3.603 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 pt -66.32 153.84 91.75 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 123.095 0.558 . . . . 0.0 110.792 169.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -60.18 161.64 19.08 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.956 2.437 . . . . 0.0 112.216 165.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -140.05 133.04 29.4 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 169.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -85.01 70.68 10.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -177.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.972 1 O4'-C1'-N19 114.872 8.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 O4'-C1'-N19 110.546 3.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.36 1 O4'-C1'-N19 112.186 5.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 1 O4'-C1'-N19 113.061 6.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.076 0 O4'-C1'-N19 110.79 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.592 0 O5'-C5'-C4' 115.773 3.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.098 1 O4'-C1'-N19 112.481 5.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.228 0 P-O3'-C3' 124.289 3.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.486 0 O4'-C4'-C3' 108.681 3.081 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 1 O4'-C1'-N19 113.499 7.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C1'-N19 110.226 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.634 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.667 3.584 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 111.221 4.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.827 0 P-O3'-C3' 122.97 2.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 113.199 6.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 111.279 4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.711 1 O4'-C1'-N19 111.368 4.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.586 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C4'-C3' 108.675 3.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 112.584 5.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.003 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 1 O4'-C1'-N19 111.009 4.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C1'-N19 110.34 3.175 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 120.708 0.29 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.9 pt -133.2 159.04 74.19 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 125.702 1.601 . . . . 0.0 109.138 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.2 140.48 44.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.329 2.02 . . . . 0.0 109.725 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -59.61 -59.49 5.36 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.752 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -135.87 155.5 50.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.48 1.912 . . . . 0.0 106.074 168.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' HIS . . . . . 0.516 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.516 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.4 ' HB3' ' SG ' ' A' ' 158' ' ' CYS . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 158' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 155' ' ' CYS . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.297 0 O4'-C1'-N19 110.835 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O4'-C1'-N19 110.629 3.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.84 0 O4'-C4'-C3' 108.653 3.053 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 112.816 6.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 114.595 8.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 1 O4'-C1'-N19 111.178 4.222 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.584 1 O4'-C1'-N19 111.538 4.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.622 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.546 0 O4'-C1'-N19 110.264 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.862 1 O4'-C1'-N19 111.647 4.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.57 1 O4'-C1'-N19 112.116 5.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 1 O4'-C1'-N19 112.51 5.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.241 1 O4'-C1'-N19 111.075 4.093 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.78 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 1 O4'-C1'-N19 112.496 5.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 1 O4'-C1'-N19 111.144 4.18 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.147 1 O4'-C1'-N19 112.447 5.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.871 1 O4'-C1'-N19 112.61 6.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C1'-N19 109.661 2.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.941 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.718 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C1'-N19 110.372 3.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.502 0 O4'-C1'-N19 110.14 2.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 P-O3'-C3' 123.427 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 21.0 tt -59.13 139.8 87.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 168.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -71.59 110.18 2.81 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.062 1.841 . . . . 0.0 109.899 169.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -139.28 167.04 22.98 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.383 1.873 . . . . 0.0 107.776 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.6 91.1 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 168.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' CYS . . . . . 0.41 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.359 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 P-O3'-C3' 123.554 3.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.12 1 O4'-C1'-N19 111.779 4.974 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 O4'-C4'-C3' 107.938 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.911 1 O4'-C1'-N19 114.511 8.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.05 0 O4'-C1'-N19 110.847 3.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.894 0 O4'-C1'-N19 110.75 3.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 0 P-O3'-C3' 123.538 3.198 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 1 O4'-C1'-N19 112.804 6.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 O4'-C1'-N19 110.745 3.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 1 O4'-C1'-N19 112.913 6.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.319 1 O4'-C1'-N19 111.012 4.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.676 3.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.031 1 O4'-C1'-N19 111.547 4.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 O4'-C1'-N19 110.535 3.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 2 O4'-C1'-N19 112.442 5.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.151 2.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.57 0 P-O3'-C3' 123.349 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.665 1 O4'-C1'-N19 112.343 5.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 113.158 6.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.625 0 O4'-C4'-C3' 108.098 2.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.71 0 O4'-C4'-C3' 108.796 3.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 113.143 6.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.13 1 O4'-C1'-N19 111.387 4.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.0 pt -131.24 156.43 80.15 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.458 1.503 . . . . 0.0 108.985 169.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -70.98 125.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.386 2.057 . . . . 0.0 108.794 167.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -154.42 170.99 20.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.468 1.507 . . . . 0.0 109.049 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -125.77 102.99 7.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 168.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.415 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.415 ' HB2' ' H ' ' A' ' 148' ' ' THR . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 1 O4'-C1'-N19 114.357 8.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.986 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.726 0 O4'-C1'-N19 110.22 3.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.395 0 O4'-C4'-C3' 108.897 3.297 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.328 1 O4'-C1'-N19 112.046 5.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 1 O4'-C1'-N19 112.304 5.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.771 0 P-O3'-C3' 123.703 3.335 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.618 0 P-O3'-C3' 122.688 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 113.243 6.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 O4'-C1'-N19 110.085 2.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.744 0 O4'-C1'-N19 110.505 3.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C1'-N19 110.622 3.527 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C1'-N19 110.441 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 2 O4'-C1'-N19 112.568 5.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.136 0 O4'-C4'-C3' 107.677 2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 1 O4'-C1'-N19 113.102 6.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 1 O4'-C1'-N19 113.799 7.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 1 O4'-C1'-N19 111.247 4.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.374 0 O4'-C1'-N19 110.281 3.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.743 0 P-O3'-C3' 123.528 3.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.8 1 O4'-C1'-N19 113.924 7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 2 O4'-C1'-N19 112.627 6.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O4'-C1'-N19 110.792 3.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.781 0 O4'-C1'-N19 110.906 3.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.428 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 43.9 pt -68.03 165.1 35.51 Favored Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 123.382 0.673 . . . . 0.0 110.307 168.609 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -65.37 85.79 0.2 Allowed 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.615 2.21 . . . . 0.0 110.875 165.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -148.96 140.19 23.15 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.309 1.843 . . . . 0.0 106.784 169.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 -66.35 110.59 3.13 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.428 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 148' ' ' THR . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.053 1 O4'-C1'-N19 111.357 4.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.596 0 P-O3'-C3' 123.482 3.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.767 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 1 O4'-C1'-N19 113.437 7.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.191 0 O4'-C1'-N19 110.984 3.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.201 1 O4'-C1'-N19 115.068 9.085 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.008 0 O5'-C5'-C4' 114.394 2.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C4'-C3' 108.693 3.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.498 1 O4'-C1'-N19 113.488 7.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 O4'-C1'-N19 110.205 3.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.795 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.176 1 O4'-C1'-N19 111.37 4.463 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.109 1 O4'-C1'-N19 111.641 4.801 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 1 O4'-C1'-N19 112.974 6.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.648 0 O4'-C1'-N19 110.125 2.907 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 1 O4'-C1'-N19 112.458 5.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 1 O4'-C1'-N19 112.935 6.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.546 0 O4'-C4'-C3' 108.757 3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.204 0 O4'-C1'-N19 110.863 3.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.83 0 P-O3'-C3' 123.479 3.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.378 1 O4'-C1'-N19 113.456 7.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.689 0 O4'-C1'-N19 110.54 3.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.779 0 O4'-C1'-N19 110.706 3.632 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.423 4.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 pt -63.34 154.28 79.19 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.799 0.44 . . . . 0.0 110.237 168.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -70.08 146.0 56.93 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.345 2.03 . . . . 0.0 110.047 168.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.58 102.0 1.75 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 168.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -63.12 127.24 30.33 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ARG . . . . . 0.422 ' HB2' ' H ' ' A' ' 148' ' ' THR . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.219 1 O4'-C1'-N19 111.36 4.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 P-O3'-C3' 123.47 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.542 0 P-O3'-C3' 123.561 3.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.93 1 O4'-C1'-N19 111.202 4.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.574 2 O4'-C1'-N19 112.488 5.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C1'-N19 110.86 3.825 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.056 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.896 0 O4'-C1'-N19 110.481 3.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.604 1 O4'-C1'-N19 113.471 7.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 1 O4'-C1'-N19 113.767 7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.55 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.002 1 O4'-C1'-N19 111.331 4.413 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.928 0 O4'-C1'-N19 110.051 2.814 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.753 1 O4'-C1'-N19 111.154 4.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.858 0 O4'-C1'-N19 110.839 3.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.723 1 P-O3'-C3' 126.464 5.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.204 6.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 1 O4'-C1'-N19 111.52 4.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 0 O4'-C1'-N19 110.004 2.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.358 0 P-O3'-C3' 124.32 3.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.236 1 O4'-C1'-N19 113.102 6.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.843 0 O4'-C1'-N19 110.258 3.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 0 O4'-C1'-N19 110.429 3.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.403 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.3 pt -66.2 156.13 85.7 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 123.054 0.541 . . . . 0.0 110.31 169.324 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.16 130.26 19.75 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.109 1.873 . . . . 0.0 108.782 167.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.88 156.4 31.06 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 169.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -119.98 43.38 2.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 169.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 158' ' ' CYS . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 155' ' ' CYS . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.253 0 O4'-C1'-N19 110.651 3.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.718 1 O4'-C1'-N19 111.668 4.835 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.422 1 O4'-C1'-N19 111.448 4.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.057 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 1 O4'-C1'-N19 113.053 6.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.758 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 1 O4'-C1'-N19 114.909 8.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.237 2.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.233 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.587 0 P-O3'-C3' 123.573 3.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.994 1 O4'-C1'-N19 113.317 6.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 1 O4'-C1'-N19 111.167 4.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.139 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.982 0 P-O3'-C3' 123.396 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.918 0 O4'-C1'-N19 110.818 3.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 0 O4'-C1'-N19 110.271 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 1 O4'-C1'-N19 112.617 6.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 1 O4'-C1'-N19 111.208 4.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.074 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.668 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.69 0 P-O3'-C3' 123.505 3.171 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.834 1 O4'-C1'-N19 113.395 6.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C1'-N19 110.482 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 1 O4'-C1'-N19 112.214 5.518 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 112.272 5.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.38 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.6 pt -138.79 158.59 69.75 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.531 1.532 . . . . 0.0 109.373 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.67 142.09 43.1 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.512 2.141 . . . . 0.0 109.75 167.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.39 166.5 30.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.581 1.552 . . . . 0.0 109.157 172.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 -127.23 98.87 5.44 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 169.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ALA . . . . . 0.473 ' HB2' " H2'" ' C' ' 17' ' ' ' DG' . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 115.143 9.179 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.118 0 O4'-C1'-N19 110.752 3.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 0 P-O3'-C3' 123.483 3.153 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 112.162 5.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 112.26 5.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.221 1 O4'-C1'-N19 111.696 4.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 O4'-C1'-N19 114.293 8.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C1'-N19 110.879 3.848 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 1 O4'-C1'-N19 113.131 6.664 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 1 O4'-C1'-N19 113.119 6.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 111.029 4.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.636 3.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O4'-C1'-N19 114.058 7.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . 0.473 " H2'" ' HB2' ' A' ' 122' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.109 1 O4'-C1'-N19 113.434 7.042 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.478 1 O4'-C1'-N19 112.464 5.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.862 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.071 1 O4'-C1'-N19 111.557 4.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 1 O4'-C1'-N19 111.34 4.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.364 0 O4'-C1'-N19 109.583 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.705 1 O4'-C1'-N19 112.262 5.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.431 3.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.007 1 O4'-C1'-N19 112.781 6.226 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 1 O4'-C1'-N19 112.313 5.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.68 152.14 90.67 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 123.407 0.683 . . . . 0.0 110.692 169.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.42 146.99 80.57 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.899 2.399 . . . . 0.0 111.654 166.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.47 152.39 51.31 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.844 1.258 . . . . 0.0 109.774 -175.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.43 123.9 21.27 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -175.192 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.637 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLY . . . . . 0.637 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.27 1 O4'-C1'-N19 111.331 4.414 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O4'-C1'-N19 110.424 3.28 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 0 P-O3'-C3' 123.487 3.155 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 1 O4'-C1'-N19 111.806 5.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 2 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 1 O4'-C1'-N19 112.711 6.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 1 O4'-C1'-N19 113.259 6.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.024 1 P-O3'-C3' 124.901 4.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.989 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C1'-N19 110.241 3.051 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 1 O4'-C1'-N19 113.446 7.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.775 1 O4'-C1'-N19 112.693 6.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.466 1 O4'-C1'-N19 112.596 5.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.164 0 O4'-C1'-N19 110.85 3.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.104 0 P-O3'-C3' 123.167 2.889 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.799 0 O5'-C5'-C4' 114.629 3.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.343 1 O4'-C1'-N19 111.739 4.923 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 P-O3'-C3' 123.939 3.532 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 113.07 6.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C1'-N19 110.075 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.873 0 C4'-C3'-O3' 118.921 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 1 P-O3'-C3' 126.555 5.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 2 O4'-C1'-N19 111.654 4.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.589 3.486 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O4'-C1'-N19 110.481 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.274 3.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 pp -134.4 162.53 57.17 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.953 1.701 . . . . 0.0 109.31 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -55.31 137.6 77.59 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.182 2.588 . . . . 0.0 111.833 168.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.43 146.25 49.02 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 167.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -70.56 90.51 0.75 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 -169.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' CYS . . . . . 0.408 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ARG . . . . . 0.468 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.168 1 O4'-C1'-N19 111.359 4.449 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 0 P-O3'-C3' 123.401 3.084 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.611 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.621 1 O4'-C1'-N19 111.646 4.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.806 1 O4'-C1'-N19 111.362 4.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 1 O4'-C1'-N19 111.732 4.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.203 0 C3'-C2'-C1' 106.654 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.783 0 O5'-C5'-C4' 114.324 2.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 0 O4'-C1'-N19 110.379 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.102 1 O4'-C1'-N19 112.721 6.152 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 112.867 6.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.675 3.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C1'-N19 110.662 3.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 111.735 4.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C1'-N19 110.988 3.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.565 2 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.002 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.865 1 O4'-C1'-N19 111.27 4.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 1 O4'-C1'-N19 113.294 6.867 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.461 0 O4'-C4'-C3' 108.664 3.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.78 0 O4'-C1'-N19 110.229 3.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.736 0 O4'-C4'-C3' 108.397 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 1 O4'-C1'-N19 111.05 4.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.851 0 O4'-C1'-N19 110.39 3.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 1 O4'-C1'-N19 111.512 4.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 . . . . . 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . 0.411 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . 0.451 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 148' ' ' THR . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . 0.411 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 . . . . . 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 . . . . . 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . 0.401 ' CD2' ' HE2' ' A' ' 124' ' ' LYS . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.401 ' HE2' ' CD2' ' A' ' 114' ' ' HIS . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 . . . . . 0 N--CA 1.465 0.313 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 0.1 OUTLIER 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.476 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.476 ' HB2' ' H ' ' A' ' 148' ' ' THR . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . 0.438 HD12 ' CE1' ' A' ' 185' ' ' TYR . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . 0.438 ' CE1' HD12 ' A' ' 169' ' ' LEU . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 . . . . . 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? . . . . . 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 . . . . . 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.417 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.417 ' HB2' ' H ' ' A' ' 148' ' ' THR . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 . . . . . 0 C--O 1.236 0.345 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.402 ' HB2' ' H ' ' A' ' 148' ' ' THR . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 182' ' ' ARG . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 . . . . . 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 106.074 -1.824 . . . . 0.0 106.074 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . 0.516 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.516 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.405 ' HB3' ' SG ' ' A' ' 158' ' ' CYS . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . 0.405 ' SG ' ' HB3' ' A' ' 155' ' ' CYS . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 . . . . . 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . 0.41 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 . . . . . 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.415 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.415 ' HB2' ' H ' ' A' ' 148' ' ' THR . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 . . . . . 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.428 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 148' ' ' THR . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 . . . . . 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . 0.422 ' HB2' ' H ' ' A' ' 148' ' ' THR . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 . . . . . 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 158' ' ' CYS . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 155' ' ' CYS . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 . . . . . 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.637 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . 0.637 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 . . . . . 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' CYS . . . . . 0.42 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' ARG . . . . . 0.468 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 8.9 tp -142.6 145.18 33.23 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 125.513 1.525 . . . . 0.0 107.315 169.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_exo -59.94 161.12 19.65 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 122.413 2.075 . . . . 0.0 112.229 166.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -67.08 105.51 1.69 Allowed 'General case' 0 C--O 1.235 0.319 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 168.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.7 mtm180 -68.84 141.25 55.16 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -169.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.7 tp -130.07 131.23 45.68 Favored 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.403 1.481 . . . . 0.0 107.116 -168.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 34.6 t -63.82 102.16 0.44 Allowed 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 167.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -75.69 -2.91 31.79 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 123.402 0.681 . . . . 0.0 112.214 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 62.9 t -68.0 -72.0 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 167.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 7.9 p -105.11 -8.02 18.72 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.827 1.251 . . . . 0.0 114.345 -167.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 76.85 63.01 2.38 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 172.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -145.89 159.49 43.14 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 125.75 1.62 . . . . 0.0 108.237 169.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 92.0 mt -59.57 122.69 10.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 -176.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -74.1 143.05 45.54 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 173.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -60.96 -45.42 94.83 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.756 0.823 . . . . 0.0 110.01 167.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.71 -157.16 14.64 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 110.124 -1.19 . . . . 0.0 110.124 169.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . 0.411 ' CD2' ' HE3' ' A' ' 184' ' ' LYS . 2.2 m-85 -67.48 135.21 52.72 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 168.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -144.77 124.67 13.47 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 106.941 -1.503 . . . . 0.0 106.941 167.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.3 m-85 53.03 54.74 9.95 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 126.204 1.802 . . . . 0.0 111.852 -168.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.59 11.23 52.78 Favored Glycine 0 CA--C 1.53 1.011 0 C-N-CA 125.598 1.571 . . . . 0.0 116.382 165.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 10.6 m -139.67 159.77 27.51 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 C-N-CA 126.501 1.92 . . . . 0.0 106.818 167.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.24 121.96 12.66 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 169.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.0 m -153.63 142.09 20.72 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.997 0.919 . . . . 0.0 109.918 174.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 24.4 p -72.34 172.54 10.18 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 122.566 1.174 . . . . 0.0 111.92 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -70.39 -37.73 74.57 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 125.33 1.452 . . . . 0.0 112.063 -169.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.17 -51.79 66.4 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.652 0.781 . . . . 0.0 110.376 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 88.7 m -55.68 -47.41 76.81 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.798 1.239 . . . . 0.0 111.546 174.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.0 ttpm? -46.5 -61.13 1.95 Allowed 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.98 0.809 . . . . 0.0 110.725 169.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.61 -46.8 87.89 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.436 0.694 . . . . 0.0 111.172 -172.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . 0.451 ' CD2' ' HD2' ' A' ' 159' ' ' ARG . 75.6 t80 -53.9 -53.55 51.04 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 123.46 0.704 . . . . 0.0 111.35 173.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -58.52 -45.04 89.67 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.774 0.83 . . . . 0.0 109.832 -172.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 36.2 mtmt -51.31 -63.3 1.18 Allowed 'General case' 0 C--N 1.342 0.24 0 CA-C-O 118.245 -0.883 . . . . 0.0 110.851 168.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -52.27 -47.08 66.01 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 118.876 0.762 . . . . 0.0 110.393 -171.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.0 m -50.93 -54.19 26.33 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.297 1.039 . . . . 0.0 110.611 178.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 84.2 mt -78.78 -58.99 3.34 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.194 0.998 . . . . 0.0 108.52 -169.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -60.25 -42.21 94.82 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.069 1.348 . . . . 0.0 109.732 -173.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.86 0.11 87.71 Favored Glycine 0 CA--C 1.532 1.15 0 C-N-CA 125.103 1.335 . . . . 0.0 113.62 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 3.5 p30 34.31 57.98 0.65 Allowed 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 127.517 2.327 . . . . 0.0 112.383 -169.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 47.2 mt -84.98 124.75 40.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 -179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 48.9 mm-40 -83.49 144.51 29.5 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.76 0.824 . . . . 0.0 108.994 169.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 67.2 m-85 -132.82 170.14 15.73 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.225 1.41 . . . . 0.0 109.906 173.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.6 p -148.31 147.97 29.89 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 126.589 1.956 . . . . 0.0 107.492 172.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 42.4 t -67.41 141.27 95.59 Favored Pre-proline 0 CA--C 1.541 0.63 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 169.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -57.33 -37.43 97.67 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 123.49 2.793 . . . . 0.0 111.747 166.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.76 -101.39 0.28 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.592 1.557 . . . . 0.0 110.072 -169.359 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.2 p -131.37 3.08 4.24 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.65 1.18 . . . . 0.0 113.421 -165.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 45.79 48.28 11.85 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.251 1.82 . . . . 0.0 111.179 -168.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -136.87 74.69 1.5 Allowed 'General case' 0 C--O 1.237 0.402 0 N-CA-C 104.838 -2.282 . . . . 0.0 104.838 169.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 73.1 m -132.53 123.87 27.36 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 125.536 1.534 . . . . 0.0 109.179 -166.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -70.43 148.02 48.82 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 165.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 13.6 mm -115.96 124.69 72.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 -172.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.429 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.7 p -126.99 175.44 8.09 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 127.874 2.469 . . . . 0.0 106.501 169.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -49.34 -50.26 40.53 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.306 0.642 . . . . 0.0 110.438 169.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 93.6 mtm-85 -59.53 -59.47 5.4 Favored 'General case' 0 N--CA 1.461 0.1 0 C-N-CA 123.538 0.735 . . . . 0.0 110.283 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.429 ' HB2' ' H ' ' A' ' 148' ' ' THR . 6.7 mmm180 -64.05 -33.99 77.0 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 118.458 -0.782 . . . . 0.0 111.776 -167.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 39.3 ptt85 -61.99 -34.37 76.05 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 118.007 -0.996 . . . . 0.0 112.784 179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -56.15 -43.07 77.94 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 119.921 1.237 . . . . 0.0 110.044 175.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -63.97 -51.31 64.91 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.412 1.085 . . . . 0.0 111.081 177.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 82.6 m -115.82 94.21 4.58 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.052 0.941 . . . . 0.0 111.208 -168.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -60.94 -45.43 94.74 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 124.497 1.119 . . . . 0.0 110.735 168.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.11 -53.12 61.86 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.793 -0.567 . . . . 0.0 110.577 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 26.0 m -63.31 -37.96 89.29 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.109 1.364 . . . . 0.0 111.826 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HD2' ' CD2' ' A' ' 126' ' ' PHE . 21.3 ttm180 -53.39 -54.51 35.74 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 123.721 0.808 . . . . 0.0 110.44 169.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -59.9 -43.59 94.74 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.264 0.625 . . . . 0.0 111.318 -179.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 66.5 ttp -53.44 -54.48 36.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.308 1.043 . . . . 0.0 111.113 172.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -55.88 -50.69 69.95 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 123.94 0.896 . . . . 0.0 109.262 179.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.37 -58.55 5.43 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.926 1.29 . . . . 0.0 111.068 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.5 mt -52.39 -51.53 58.48 Favored 'General case' 0 C--O 1.233 0.223 0 C-N-CA 123.988 0.915 . . . . 0.0 112.326 173.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.8 tttm -54.23 -53.75 49.4 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 123.981 0.912 . . . . 0.0 110.638 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.1 m -68.1 -42.61 85.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 CA-C-O 119.014 -0.517 . . . . 0.0 111.131 -172.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.54 14.01 0.08 OUTLIER Glycine 0 C--N 1.34 0.776 0 CA-C-O 118.044 -1.42 . . . . 0.0 114.816 168.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 85.3 mtp -72.87 96.33 2.08 Favored 'General case' 0 CA--C 1.529 0.167 0 N-CA-C 104.848 -2.279 . . . . 0.0 104.848 166.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 28.3 mt -74.45 138.86 43.54 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 -176.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -46.29 -54.49 8.8 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 123.923 0.889 . . . . 0.0 110.574 169.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.01 -13.39 34.76 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.94 1.296 . . . . 0.0 113.502 -179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.69 -49.97 63.03 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.564 1.078 . . . . 0.0 111.225 168.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.7 t -62.54 116.33 2.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 107.713 -1.218 . . . . 0.0 107.713 172.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 78.1 mtp85 -76.33 132.28 39.69 Favored 'General case' 0 C--O 1.231 0.112 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 169.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 48.8 tp -72.45 -23.41 61.06 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.274 0.63 . . . . 0.0 110.016 166.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -64.42 -31.01 72.05 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 127.275 2.23 . . . . 0.0 111.508 173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.1 mtp180 57.08 60.56 2.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 125.188 1.395 . . . . 0.0 112.227 166.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.9 m -119.13 119.94 62.35 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 C-N-CA 124.177 0.991 . . . . 0.0 108.609 -177.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 31.3 mtt180 -61.64 151.6 33.06 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.2 0.524 . . . . 0.0 110.547 -169.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.425 ' H ' " H1'" ' B' ' 6' ' ' ' DA' . . . 69.63 7.84 59.05 Favored Glycine 0 CA--C 1.527 0.826 0 C-N-CA 124.694 1.14 . . . . 0.0 115.499 169.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -80.93 81.47 1.61 Allowed Glycine 0 C--N 1.338 0.66 0 CA-C-N 119.091 1.445 . . . . 0.0 109.836 178.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -53.18 138.15 32.39 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.584 1.154 . . . . 0.0 110.244 -169.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -134.96 45.81 2.5 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.207 1.403 . . . . 0.0 108.903 -168.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . 0.411 ' HE3' ' CD2' ' A' ' 113' ' ' TYR . 39.1 mtpt -70.41 112.29 6.6 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 104.785 -2.302 . . . . 0.0 104.785 166.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -62.12 128.99 38.73 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.498 0.665 . . . . 0.0 111.1 -166.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt . . . . . 0 C--O 1.236 0.365 0 C-N-CA 128.013 2.525 . . . . 0.0 107.42 169.877 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.012 1 O4'-C1'-N19 113.948 7.685 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 1 O4'-C1'-N19 112.47 5.837 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 0 O4'-C1'-N19 109.951 2.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.676 0 O4'-C4'-C3' 109.245 3.645 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 1 O4'-C1'-N19 112.304 5.631 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . 0.425 " H1'" ' H ' ' A' ' 180' ' ' GLY . . . . . . . . 0 C5'--C4' 1.54 3.679 1 O4'-C1'-N19 112.543 5.929 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.7 1 O4'-C1'-N19 116.878 11.347 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.283 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.683 0 O4'-C1'-N19 109.749 2.436 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 1 O4'-C1'-N19 113.728 7.409 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.41 0 O4'-C1'-N19 110.132 2.915 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.543 3.429 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.23 0 O4'-C1'-N19 110.575 3.468 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.638 1 O4'-C1'-N19 114.095 7.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 0 O4'-C1'-N19 110.548 3.435 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.286 2 O4'-C1'-N19 111.21 4.263 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.166 0 O5'-C5'-C4' 113.417 2.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.783 1 O4'-C1'-N19 112.459 5.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 1 O4'-C1'-N19 113.524 7.155 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 1 O4'-C1'-N19 112.4 5.75 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.543 0 O4'-C4'-C3' 108.15 2.55 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.588 0 P-O3'-C3' 123.764 3.387 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 113.211 6.764 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 0 O4'-C1'-N19 110.605 3.506 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . 0.407 H2'' ' C6 ' ' C' ' 26' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.534 2.826 2 C5'-C4'-C3' 107.5 -4.8 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . 0.407 ' C6 ' H2'' ' C' ' 25' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.536 3.137 0 O4'-C1'-N19 109.791 2.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.385 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 38.8 mm -61.37 124.25 79.88 Favored Pre-proline 0 CA--C 1.542 0.651 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 168.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.1 139.14 41.73 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.632 2.221 . . . . 0.0 112.232 -167.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -142.38 165.88 26.21 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 127.503 2.321 . . . . 0.0 106.591 166.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 88.8 mtt180 -60.28 150.97 28.73 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.828 0.347 . . . . 0.0 110.111 169.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.3 mt -69.12 147.62 51.15 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 167.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 42.2 t -55.01 131.42 44.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.479 1.512 . . . . 0.0 108.671 167.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 8.4 mp -67.02 -34.39 77.63 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 122.907 0.483 . . . . 0.0 110.582 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.2 t -70.21 -70.2 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 123.676 0.791 . . . . 0.0 109.149 -173.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.1 p -85.26 -77.55 0.28 Allowed 'General case' 0 C--O 1.234 0.242 0 CA-C-N 119.335 0.97 . . . . 0.0 109.507 -178.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.73 67.34 0.1 OUTLIER Glycine 0 CA--C 1.52 0.4 0 N-CA-C 108.405 -1.878 . . . . 0.0 108.405 -169.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 53.2 t0 -145.95 159.48 43.18 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 126.881 2.072 . . . . 0.0 106.449 171.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.85 116.16 3.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -172.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -69.02 146.53 52.62 Favored 'General case' 0 C--O 1.234 0.26 0 C-N-CA 123.539 0.735 . . . . 0.0 109.251 -176.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.27 -43.9 97.76 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 123.706 0.802 . . . . 0.0 110.166 168.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 178.44 -169.05 40.54 Favored Glycine 0 CA--C 1.526 0.743 0 C-N-CA 124.787 1.184 . . . . 0.0 110.563 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -68.21 122.38 18.19 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 168.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 46.5 m80 -136.65 134.49 37.35 Favored 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 125.079 1.352 . . . . 0.0 108.254 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 46.93 41.97 11.57 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.4 1.08 . . . . 0.0 110.163 -165.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.83 11.36 78.07 Favored Glycine 0 CA--C 1.534 1.22 0 C-N-CA 125.858 1.694 . . . . 0.0 116.3 167.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 11.7 m -140.0 156.11 24.84 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 119.715 1.757 . . . . 0.0 108.581 167.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.66 116.24 3.9 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.587 -0.696 . . . . 0.0 109.589 178.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.3 m -149.3 139.81 22.49 Favored 'General case' 0 C--O 1.239 0.512 0 C-N-CA 124.758 1.223 . . . . 0.0 109.14 -175.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.1 m -59.85 162.07 5.8 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.181 0.993 . . . . 0.0 111.541 173.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 60.4 mm-40 -58.65 -40.85 84.64 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 123.512 0.725 . . . . 0.0 110.592 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.54 -50.45 73.05 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.978 0.911 . . . . 0.0 111.152 176.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -59.39 -49.47 77.69 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.616 1.566 . . . . 0.0 110.987 177.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 32.5 ttpt -47.1 -57.32 5.21 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 124.241 1.016 . . . . 0.0 109.951 170.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.94 -47.68 82.16 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.6 1.16 . . . . 0.0 111.791 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -55.7 -54.96 37.89 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.007 0.923 . . . . 0.0 111.269 174.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -58.84 -51.46 69.93 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.271 1.029 . . . . 0.0 111.051 -176.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.6 ttpt -44.95 -62.12 1.35 Allowed 'General case' 0 C--O 1.235 0.304 0 C-N-CA 128.16 2.584 . . . . 0.0 111.398 170.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 23.1 mtp180 -47.94 -52.85 17.95 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 118.356 -0.83 . . . . 0.0 111.946 175.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 39.9 m -52.65 -49.86 64.36 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.109 0.563 . . . . 0.0 110.228 -172.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 94.0 mt -74.33 -58.47 4.7 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -173.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -60.39 -38.96 85.61 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.381 0.537 . . . . 0.0 110.753 -173.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.83 -6.5 89.38 Favored Glycine 0 CA--C 1.53 1.019 0 C-N-CA 125.367 1.46 . . . . 0.0 113.708 179.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 49.56 2.92 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.053 2.141 . . . . 0.0 111.9 -167.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.9 mm -71.35 150.72 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 124.768 1.227 . . . . 0.0 108.031 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.74 153.75 45.09 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 125.12 1.368 . . . . 0.0 108.579 169.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -134.85 -175.79 4.02 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.34 1.456 . . . . 0.0 110.46 -168.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 12.3 p -149.71 170.33 18.96 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 126.547 1.939 . . . . 0.0 109.188 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 46.7 t -135.22 147.1 60.9 Favored Pre-proline 0 CA--C 1.54 0.575 0 C-N-CA 127.475 2.31 . . . . 0.0 106.889 169.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -73.7 -18.2 22.44 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 122.827 2.352 . . . . 0.0 111.996 168.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.72 -128.44 0.22 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.936 1.695 . . . . 0.0 110.588 -168.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.66 -16.72 63.92 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.28 2.232 . . . . 0.0 114.733 -165.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.271 0.3 OUTLIER 53.25 19.83 1.67 Allowed 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 127.098 2.159 . . . . 0.0 113.9 -167.003 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -145.58 51.94 1.18 Allowed 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.904 2.081 . . . . 0.0 106.656 167.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 88.7 m -63.27 140.59 58.89 Favored 'General case' 0 C--O 1.235 0.319 0 O-C-N 121.635 -0.666 . . . . 0.0 109.61 169.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -63.95 142.72 58.31 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 167.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 31.8 mm -111.47 135.28 51.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 70.4 p -133.46 179.08 6.43 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 127.986 2.515 . . . . 0.0 106.087 168.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -50.92 -43.59 60.0 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.34 -0.85 . . . . 0.0 110.954 169.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 80.3 ttt180 -65.49 -63.87 0.99 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.127 0.971 . . . . 0.0 110.879 174.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 42.5 mmm-85 -64.33 -19.34 65.38 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -168.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 58.2 ttt85 -30.71 -60.08 0.19 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 126.535 1.934 . . . . 0.0 112.595 168.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -91.2 -2.42 57.5 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -169.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 16.2 m -58.27 -47.14 84.52 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.585 1.084 . . . . 0.0 110.367 169.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 55.7 m -128.34 176.24 7.86 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.744 1.617 . . . . 0.0 109.433 -169.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -131.17 -43.69 1.05 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.351 1.46 . . . . 0.0 109.038 169.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -52.97 -58.51 6.73 Favored 'General case' 0 C--N 1.342 0.276 0 C-N-CA 124.088 0.955 . . . . 0.0 110.583 175.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 18.7 m -52.22 -42.69 63.76 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 125.746 1.618 . . . . 0.0 111.761 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 18.9 ttm180 -59.3 -55.26 37.12 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.093 0.957 . . . . 0.0 109.339 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -62.76 -41.8 99.39 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.951 0.9 . . . . 0.0 111.266 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -56.74 -52.63 64.23 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.769 1.228 . . . . 0.0 110.261 177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -59.17 -45.47 90.93 Favored 'General case' 0 C--O 1.225 -0.205 0 CA-C-O 118.053 -0.975 . . . . 0.0 109.813 176.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.81 -54.99 19.02 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.932 0.787 . . . . 0.0 111.125 178.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.9 mt -50.24 -54.41 21.34 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.996 0.918 . . . . 0.0 112.219 169.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -53.99 -53.54 51.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.404 1.081 . . . . 0.0 111.114 -176.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -65.51 -42.66 93.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 CA-C-N 118.515 0.598 . . . . 0.0 110.63 -175.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 150.9 15.24 0.08 OUTLIER Glycine 0 C--N 1.34 0.76 0 CA-C-O 118.013 -1.437 . . . . 0.0 115.324 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.2 mtp -73.24 94.46 1.99 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 166.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 41.0 mt -75.31 137.36 41.09 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 108.397 -0.964 . . . . 0.0 108.397 -174.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.8 -25.39 27.88 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 168.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -62.22 -23.28 66.55 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.731 1.612 . . . . 0.0 111.966 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.6 -46.66 91.72 Favored Glycine 0 CA--C 1.529 0.967 0 C-N-CA 124.962 1.268 . . . . 0.0 112.251 -172.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 93.7 t -59.76 118.39 2.94 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 75.4 mtt180 -76.04 119.43 19.97 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 178.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 52.5 tp -58.3 -32.86 68.85 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.661 0.784 . . . . 0.0 111.18 169.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -59.45 -21.43 60.03 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 125.278 1.431 . . . . 0.0 113.065 173.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 52.4 60.2 3.98 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.757 2.023 . . . . 0.0 110.819 169.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 9.0 m -117.43 131.62 69.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 C-N-CA 126.189 1.795 . . . . 0.0 106.412 173.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.4 ttm180 -65.76 149.52 50.01 Favored 'General case' 0 C--O 1.236 0.374 0 O-C-N 122.154 -0.341 . . . . 0.0 110.717 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 64.46 44.91 94.56 Favored Glycine 0 CA--C 1.521 0.423 0 N-CA-C 111.524 -0.63 . . . . 0.0 111.524 169.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -81.84 63.5 4.37 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 110.489 -1.044 . . . . 0.0 110.489 -172.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -59.9 149.5 31.45 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.532 1.133 . . . . 0.0 110.151 -173.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -164.52 167.12 19.75 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 124.89 1.276 . . . . 0.0 108.795 -168.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -143.99 141.47 30.17 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 124.632 1.173 . . . . 0.0 108.92 169.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -81.18 -175.2 5.31 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 168.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? . . . . . 0 C--O 1.238 0.45 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 167.034 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . 0.4 " H1'" ' C6 ' ' B' ' 2' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.544 4.063 1 O4'-C1'-N19 114.103 7.879 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . 0.4 ' C6 ' " H1'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.534 2.847 1 O4'-C1'-N19 112.397 5.746 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.878 1 O4'-C1'-N19 111.669 4.836 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.361 1 O4'-C1'-N19 112.405 5.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.214 4.267 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.72 3.649 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.119 2 O4'-C1'-N19 114.183 7.979 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.056 0 O4'-C1'-N19 110.17 2.963 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.966 1 O4'-C1'-N19 112.398 5.748 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.346 1 O4'-C1'-N19 113.755 7.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.321 0 O4'-C1'-N19 110.406 3.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.78 0 O4'-C1'-N19 110.577 3.471 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.18 0 O4'-C1'-N19 110.615 3.519 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.63 1 O4'-C1'-N19 114.155 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.802 0 O4'-C1'-N19 110.872 3.84 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.558 2 O4'-C1'-N19 112.488 5.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.746 0 O5'-C5'-C4' 113.62 2.443 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 111.728 4.911 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.701 1 O4'-C1'-N19 113.113 6.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.371 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 1 O4'-C1'-N19 111.388 4.485 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 112.168 5.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.25 2 O4'-C1'-N19 114.745 8.681 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.297 0 O4'-C1'-N19 109.914 2.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.963 0 O4'-C1'-N19 109.944 2.68 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.865 1 O4'-C1'-N19 111.083 4.104 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.435 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 42.7 pt -133.97 163.49 50.74 Favored Pre-proline 0 CA--C 1.539 0.543 0 C-N-CA 125.802 1.641 . . . . 0.0 109.115 170.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_exo -55.47 132.76 54.11 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.014 2.476 . . . . 0.0 111.001 167.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.2 mptp? -74.4 -79.65 0.09 Allowed 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 169.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.65 140.26 44.14 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 107.197 -1.408 . . . . 0.0 107.197 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 19.3 tp -137.58 130.96 30.93 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 170.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.5 t -65.95 128.35 35.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.342 0.657 . . . . 0.0 109.323 -174.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -78.31 -34.29 48.79 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.413 0.685 . . . . 0.0 110.727 168.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.2 t -66.86 -64.45 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.192 0 C-N-CA 125.108 1.363 . . . . 0.0 110.256 -167.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.0 p -88.28 -85.41 0.19 Allowed 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 169.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 144.7 72.83 0.02 OUTLIER Glycine 0 CA--C 1.52 0.402 0 N-CA-C 107.93 -2.068 . . . . 0.0 107.93 -169.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.4 t0 -148.45 174.28 12.24 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.499 1.92 . . . . 0.0 106.988 169.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 74.9 mt -62.85 111.67 0.92 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 169.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.73 137.75 47.97 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 168.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.48 -45.63 92.15 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.578 0.751 . . . . 0.0 111.374 169.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -166.55 -178.75 39.37 Favored Glycine 0 CA--C 1.524 0.626 0 O-C-N 121.761 -0.587 . . . . 0.0 111.736 -168.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -70.36 132.38 45.56 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 168.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 71.0 m80 -137.41 138.12 39.51 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 125.297 1.439 . . . . 0.0 108.801 169.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 38.85 50.76 1.74 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.153 1.781 . . . . 0.0 111.166 -168.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 70.48 15.5 73.0 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 125.393 1.473 . . . . 0.0 116.294 167.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.3 m -141.63 161.73 21.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 CA-C-N 119.385 1.592 . . . . 0.0 108.761 168.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.94 120.2 12.13 Favored 'General case' 0 C--O 1.237 0.404 0 O-C-N 121.198 -0.939 . . . . 0.0 109.48 171.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 3.5 m -153.17 155.04 35.94 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 124.099 0.959 . . . . 0.0 109.859 177.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.1 m -67.79 163.88 20.79 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-O 121.763 0.792 . . . . 0.0 111.219 172.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -60.09 -35.73 75.84 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.076 0.95 . . . . 0.0 110.391 167.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.47 -50.12 70.71 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.702 0.801 . . . . 0.0 111.775 172.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 14.6 m -63.29 -47.73 81.09 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.716 1.606 . . . . 0.0 109.722 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.65 -55.09 8.26 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.388 1.475 . . . . 0.0 110.15 168.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.77 -51.18 70.42 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.656 0.782 . . . . 0.0 111.331 -176.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -47.8 -56.92 6.35 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.0 1.32 . . . . 0.0 112.211 170.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -60.71 -48.57 81.22 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 123.854 0.861 . . . . 0.0 109.952 -173.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -50.38 -58.85 4.76 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 125.989 1.715 . . . . 0.0 111.197 172.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -47.56 -54.22 12.32 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.245 1.018 . . . . 0.0 111.4 176.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 42.2 m -55.37 -48.47 74.21 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.273 0.629 . . . . 0.0 110.1 -171.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.1 mt -73.7 -55.83 11.24 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -173.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.3 mt-30 -60.37 -42.36 95.64 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.274 0.629 . . . . 0.0 110.604 -174.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.68 -4.03 84.43 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 125.507 1.527 . . . . 0.0 113.472 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.79 47.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 127.028 2.131 . . . . 0.0 111.679 -167.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 25.7 mt -69.29 137.03 25.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -118.96 151.84 37.44 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.763 1.225 . . . . 0.0 108.239 172.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 41.9 m-85 -140.08 171.71 13.8 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.418 1.487 . . . . 0.0 109.856 -168.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -150.27 139.51 21.25 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 128.388 2.675 . . . . 0.0 105.303 168.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.8 t -64.21 141.12 98.07 Favored Pre-proline 0 CA--C 1.54 0.565 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 177.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_exo -60.47 -32.08 93.3 Favored 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 123.057 2.505 . . . . 0.0 111.732 165.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -124.11 -135.12 0.28 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.847 1.659 . . . . 0.0 110.957 -167.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -68.37 -13.71 62.48 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 127.762 2.425 . . . . 0.0 114.311 -166.11 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 51.32 52.87 13.94 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 126.788 2.035 . . . . 0.0 112.447 -168.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -154.83 28.93 0.42 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.9 1.28 . . . . 0.0 109.947 167.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.9 m -68.17 128.55 36.95 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 124.059 0.944 . . . . 0.0 110.795 -168.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -72.71 95.13 1.84 Allowed 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 106.116 -1.809 . . . . 0.0 106.116 167.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 52.1 mm -63.27 143.0 16.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 175.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 76.9 p -133.91 176.13 8.84 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 127.372 2.269 . . . . 0.0 106.774 168.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -53.4 -41.71 66.24 Favored 'General case' 0 N--CA 1.467 0.405 0 O-C-N 121.418 -0.801 . . . . 0.0 111.525 175.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.08 -62.49 1.4 Allowed 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 123.75 0.82 . . . . 0.0 110.976 172.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -62.24 -23.71 66.83 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.569 0.748 . . . . 0.0 112.428 -167.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 38.3 ttm180 -41.13 -51.9 3.35 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 124.739 1.216 . . . . 0.0 110.778 168.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -61.69 -42.59 99.14 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 118.621 0.646 . . . . 0.0 110.422 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 8.1 m -64.67 -55.31 20.92 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.001 1.32 . . . . 0.0 110.417 -176.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -81.63 -179.16 7.27 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 121.777 0.799 . . . . 0.0 111.742 -168.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -139.92 -74.99 0.35 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 126.07 1.748 . . . . 0.0 108.546 -169.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -72.5 -45.27 60.21 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 123.509 0.724 . . . . 0.0 111.005 -170.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 81.3 m -57.53 -32.72 67.36 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.002 1.321 . . . . 0.0 112.53 -170.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -48.24 -56.28 8.38 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.612 0.765 . . . . 0.0 111.04 171.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -68.64 -48.54 63.77 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 118.06 0.391 . . . . 0.0 110.624 -169.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 25.0 ptm -62.01 -40.35 95.37 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 118.674 -0.679 . . . . 0.0 111.653 178.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.05 -48.24 82.55 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-N 119.745 1.157 . . . . 0.0 109.79 174.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.85 -53.79 29.34 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 123.931 0.892 . . . . 0.0 111.15 177.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.3 mt -50.56 -54.94 18.59 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.274 1.029 . . . . 0.0 112.234 171.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -57.49 -50.53 72.76 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.666 0.786 . . . . 0.0 111.567 -176.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 30.1 m -62.46 -39.27 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.097 0.862 . . . . 0.0 110.286 -178.52 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.5 14.4 0.2 Allowed Glycine 0 C--N 1.341 0.829 0 CA-C-O 117.877 -1.513 . . . . 0.0 115.191 165.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 76.5 mtp -72.43 94.85 1.69 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 120.171 1.986 . . . . 0.0 106.007 167.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 18.1 mt -71.55 135.4 47.03 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -46.22 -46.19 17.43 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.66 1.184 . . . . 0.0 111.156 171.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.07 -27.87 15.43 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 126.592 1.957 . . . . 0.0 113.114 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -45.67 -52.61 9.15 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.08 1.324 . . . . 0.0 113.146 169.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.1 t -73.25 119.0 19.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.395 0 N-CA-C 107.262 -1.384 . . . . 0.0 107.262 169.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.41 150.88 23.99 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.7 mt -67.44 -35.99 80.31 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.298 0.639 . . . . 0.0 110.244 168.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.87 -40.2 69.47 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.401 1.48 . . . . 0.0 111.548 172.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 7.8 ttm180 50.35 43.85 26.67 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.641 1.977 . . . . 0.0 113.086 167.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 33.9 m -88.22 149.49 4.04 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 168.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 23.6 mtt180 -60.98 156.24 18.16 Favored 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 120.947 0.404 . . . . 0.0 111.073 -176.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 59.36 43.22 97.53 Favored Glycine 0 CA--C 1.522 0.478 0 C-N-CA 125.263 1.411 . . . . 0.0 113.785 168.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -63.01 152.67 46.24 Favored Glycine 0 CA--C 1.527 0.842 0 N-CA-C 111.139 -0.785 . . . . 0.0 111.139 169.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 20.6 mmm180 -131.36 118.54 20.43 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 -169.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -152.58 150.72 29.84 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.526 1.13 . . . . 0.0 108.769 -173.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -139.05 127.46 22.91 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 106.144 -1.799 . . . . 0.0 106.144 169.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.42 134.49 50.28 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 57.2 tttp . . . . . 0 C--O 1.236 0.354 0 N-CA-C 107.992 -1.114 . . . . 0.0 107.992 170.746 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 115.037 9.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.507 3.384 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.703 3.103 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.731 1 O4'-C1'-N19 111.957 5.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 113.721 7.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.661 0 O5'-C5'-C4' 114.047 2.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.173 6.716 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.658 4.823 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.556 0 O4'-C4'-C3' 108.459 2.859 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.703 1 O4'-C1'-N19 113.282 6.853 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.695 1 O4'-C1'-N19 112.944 6.43 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.394 1 O4'-C1'-N19 111.335 4.418 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.276 0 O4'-C1'-N19 110.611 3.514 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.119 1 O4'-C1'-N19 111.556 4.695 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.413 0 O5'-C5'-C4' 114.239 2.885 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.815 1 O4'-C1'-N19 111.575 4.718 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.414 -2.9 0 O5'-C5'-C4' 113.716 2.511 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.848 1 O4'-C1'-N19 113.188 6.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.541 0 O4'-C1'-N19 110.986 3.983 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.859 1 O4'-C1'-N19 111.718 4.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.621 3.526 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.53 0 P-O3'-C3' 123.673 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.43 1 O4'-C1'-N19 113.397 6.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 0 O4'-C1'-N19 110.63 3.538 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.87 0 O5'-C5'-C4' 114.719 3.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.07 0 O4'-C1'-N19 110.33 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.195 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 40.7 pt -135.16 168.79 15.99 Favored Pre-proline 0 CA--C 1.541 0.598 0 C-N-CA 126.549 1.94 . . . . 0.0 108.199 169.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_exo -55.12 121.79 10.54 Favored 'Trans proline' 0 N--CA 1.456 -0.693 0 C-N-CA 122.614 2.209 . . . . 0.0 109.457 165.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 64.9 tttp -148.42 -60.11 0.24 Allowed 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 123.94 0.896 . . . . 0.0 109.816 -167.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 41.8 mmt-85 -59.7 147.42 37.72 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 170.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -68.05 171.3 7.05 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 165.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 46.1 t -54.58 122.48 10.68 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 123.595 0.758 . . . . 0.0 109.181 175.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.2 mp -62.75 -37.25 85.86 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.363 0.665 . . . . 0.0 110.447 176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 18.7 t -70.0 -64.13 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 123.852 0.861 . . . . 0.0 109.721 -169.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.0 p -87.93 -85.61 0.18 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 119.188 0.903 . . . . 0.0 108.602 175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 141.2 66.41 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.4 0 N-CA-C 108.276 -1.93 . . . . 0.0 108.276 -168.593 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -141.1 154.78 46.09 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 125.797 1.639 . . . . 0.0 107.254 169.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -61.24 120.26 6.77 Favored 'Isoleucine or valine' 0 C--O 1.236 0.371 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 -170.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.67 133.72 50.8 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 -172.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 13.1 p -66.32 -38.67 88.22 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.903 0.481 . . . . 0.0 110.523 169.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -172.76 -179.79 43.74 Favored Glycine 0 C--N 1.339 0.711 0 CA-C-N 118.267 0.485 . . . . 0.0 112.403 176.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -71.99 131.91 43.57 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 167.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . 0.401 ' CD2' ' HE2' ' A' ' 124' ' ' LYS . 4.0 m80 -139.74 140.72 36.81 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 166.738 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 42.33 43.69 3.09 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.266 1.426 . . . . 0.0 112.157 -169.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 82.79 4.23 90.15 Favored Glycine 0 CA--C 1.527 0.798 0 C-N-CA 126.616 2.055 . . . . 0.0 116.563 166.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.6 m -137.42 154.61 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-N 120.058 1.929 . . . . 0.0 110.212 169.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.64 126.27 23.18 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.23 1.012 . . . . 0.0 110.118 171.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 5.4 p -155.98 164.13 38.85 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.409 1.084 . . . . 0.0 110.16 -174.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.5 m -76.9 163.21 26.96 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 121.494 -0.753 . . . . 0.0 110.941 168.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.55 -40.91 96.38 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.906 0.882 . . . . 0.0 110.785 168.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -61.93 -47.44 84.92 Favored 'General case' 0 CA--C 1.53 0.174 0 O-C-N 121.853 -0.529 . . . . 0.0 111.034 178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.3 m -55.03 -50.92 67.87 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.985 1.314 . . . . 0.0 110.333 176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.401 ' HE2' ' CD2' ' A' ' 114' ' ' HIS . 11.6 ttmt -47.9 -60.45 2.58 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.828 0.851 . . . . 0.0 111.136 169.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.85 -50.24 73.97 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.769 0.827 . . . . 0.0 111.069 -171.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -52.44 -55.34 22.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.128 1.371 . . . . 0.0 111.08 173.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 55.5 t80 -56.55 -52.97 62.76 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.085 0.954 . . . . 0.0 110.21 -177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -50.6 -54.05 25.81 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 126.083 1.753 . . . . 0.0 111.644 178.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 67.0 mtp85 -50.67 -50.5 54.58 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.515 0.726 . . . . 0.0 110.427 174.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -53.61 -46.24 70.36 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-O 118.397 -0.811 . . . . 0.0 111.006 -179.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 9.1 mm -66.85 -66.2 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 -174.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -72.33 -30.95 65.24 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 122.93 0.492 . . . . 0.0 111.2 -167.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.9 -3.72 87.99 Favored Glycine 0 CA--C 1.532 1.12 0 C-N-CA 124.918 1.247 . . . . 0.0 113.771 173.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.21 57.04 0.26 Allowed 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 128.856 2.862 . . . . 0.0 111.967 -166.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 21.1 mm -76.36 151.13 6.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 -176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -125.22 152.05 45.07 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.471 1.508 . . . . 0.0 108.704 172.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 36.7 m-85 -137.3 170.87 15.35 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 125.568 1.547 . . . . 0.0 110.011 -169.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 m -140.83 133.77 29.16 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.076 1.75 . . . . 0.0 107.582 176.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 14.3 t -65.89 146.13 99.01 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 169.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -71.73 -37.02 5.63 Favored 'Trans proline' 0 CA--C 1.536 0.606 0 C-N-CA 122.654 2.236 . . . . 0.0 110.48 167.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -87.93 -140.06 0.11 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.016 1.326 . . . . 0.0 108.177 168.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 4.7 m -127.21 69.08 1.28 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.997 0.919 . . . . 0.0 108.884 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 37.71 70.79 0.17 Allowed 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 128.054 2.542 . . . . 0.0 112.096 -173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -149.54 3.54 0.57 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.801 0.84 . . . . 0.0 112.592 -169.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 49.0 m -67.27 119.29 11.9 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.05 102.09 7.27 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 104.892 -2.262 . . . . 0.0 104.892 166.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -72.75 130.39 35.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 108.591 -0.892 . . . . 0.0 108.591 -169.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.4 p -133.25 177.49 7.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 127.555 2.342 . . . . 0.0 107.439 178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -61.65 -27.28 68.56 Favored 'General case' 0 N--CA 1.469 0.479 0 O-C-N 121.12 -0.987 . . . . 0.0 113.341 -169.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -76.26 -60.14 2.46 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 123.731 0.813 . . . . 0.0 109.84 169.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -61.85 -23.74 66.46 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.931 1.292 . . . . 0.0 113.023 -167.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 ptt180 -53.57 -37.42 62.9 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 118.689 0.677 . . . . 0.0 112.788 177.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -69.86 -45.98 66.53 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 119.745 1.157 . . . . 0.0 110.602 169.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 4.6 m -59.55 -46.39 89.01 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 125.683 1.593 . . . . 0.0 111.976 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 46.5 t -117.95 112.6 20.52 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 124.379 1.071 . . . . 0.0 109.22 176.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 84.5 mt-30 -66.42 -50.72 62.47 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.627 1.571 . . . . 0.0 110.298 170.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.48 -58.27 9.32 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.991 0.916 . . . . 0.0 110.762 -168.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 98.9 m -57.29 -39.35 75.55 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 118.093 -0.956 . . . . 0.0 111.868 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 53.0 ttt180 -54.86 -55.46 30.11 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 120.082 1.31 . . . . 0.0 110.065 174.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.8 t80 -59.82 -51.0 71.6 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.201 0.455 . . . . 0.0 111.06 -177.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 99.6 mtp -62.64 -43.97 97.47 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.376 0.67 . . . . 0.0 110.819 -176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 82.6 tttt -58.75 -49.75 76.48 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 117.761 -1.114 . . . . 0.0 109.984 172.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.53 -51.89 51.49 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 119.291 0.951 . . . . 0.0 111.415 -176.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.82 -58.73 3.98 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 124.514 1.126 . . . . 0.0 112.123 169.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 57.1 mtmt -58.1 -52.04 67.21 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.224 0.61 . . . . 0.0 111.361 -176.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.5 m -65.24 -41.7 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 CA-C-N 118.601 0.637 . . . . 0.0 110.71 -171.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 159.65 -0.18 0.08 OUTLIER Glycine 0 C--N 1.342 0.88 0 CA-C-O 117.599 -1.667 . . . . 0.0 116.666 168.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 97.3 mtp -74.82 90.52 2.37 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.897 2.348 . . . . 0.0 106.162 168.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 16.2 mt -73.55 145.66 45.36 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.69 -35.45 63.61 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.968 -0.458 . . . . 0.0 112.178 169.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -68.64 0.11 4.56 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 175.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.86 -36.27 93.15 Favored Glycine 0 CA--C 1.531 1.086 0 O-C-N 120.88 -1.137 . . . . 0.0 110.28 164.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 79.4 t -77.7 146.49 8.31 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.552 0 C-N-CA 125.024 1.329 . . . . 0.0 108.142 167.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.82 140.66 48.08 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 125.404 1.481 . . . . 0.0 108.629 179.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 58.8 tp -63.45 -45.6 90.12 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.696 0.798 . . . . 0.0 111.178 -168.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.5 t0 -70.43 -10.53 59.36 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.932 0.893 . . . . 0.0 112.677 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 2.3 tpt180 49.84 48.5 21.65 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 128.011 2.525 . . . . 0.0 112.762 168.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 21.3 t -81.29 104.05 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 105.698 -1.964 . . . . 0.0 105.698 -174.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.8 ttm-85 -60.41 151.15 28.81 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.706 0.802 . . . . 0.0 112.924 -165.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 68.87 31.22 72.59 Favored Glycine 0 CA--C 1.526 0.745 0 C-N-CA 125.227 1.394 . . . . 0.0 113.065 168.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -69.05 -178.52 18.78 Favored Glycine 0 CA--C 1.535 1.312 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 168.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 53.6 mtt-85 -128.65 107.65 9.86 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -84.48 120.76 26.69 Favored 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 105.214 -2.143 . . . . 0.0 105.214 166.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 33.9 ttmt -146.08 83.41 1.63 Allowed 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -169.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -60.76 152.84 25.83 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 125.038 1.335 . . . . 0.0 109.932 179.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 40.6 mttm . . . . . 0 C--O 1.235 0.331 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -169.459 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.752 1 O4'-C1'-N19 115.103 9.129 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.101 0 O4'-C1'-N19 110.906 3.882 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.662 0 P-O3'-C3' 123.42 3.1 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.947 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.416 2 O4'-C1'-N19 114.468 8.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.483 0 O4'-C1'-N19 110.727 3.659 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 2 P-O3'-C3' 127.509 6.507 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.41 0 O5'-C5'-C4' 114.613 3.152 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.601 0 O4'-C1'-N19 110.715 3.644 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.983 1 O4'-C1'-N19 111.685 4.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.932 0 O4'-C1'-N19 110.08 2.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.33 0 O4'-C1'-N19 110.718 3.647 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.246 0 O4'-C1'-N19 110.764 3.705 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.04 1 O4'-C1'-N19 111.026 4.032 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.754 1 O4'-C1'-N19 111.297 4.371 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.714 1 O4'-C1'-N19 112.868 6.336 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -3.011 0 O5'-C5'-C4' 113.585 2.418 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.881 0 O4'-C1'-N19 110.84 3.799 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.653 0 O4'-C1'-N19 110.331 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.569 0 O4'-C4'-C3' 108.531 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.379 0 O4'-C1'-N19 110.403 3.253 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.598 0 P-O3'-C3' 123.321 3.018 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.488 1 O4'-C1'-N19 113.704 7.38 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.149 0 O4'-C1'-N19 110.248 3.06 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.999 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.284 1 O4'-C1'-N19 111.378 4.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.595 0 CA-C-O 121.082 0.468 . . . . 0.0 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.0 pt -56.79 153.42 22.37 Favored Pre-proline 0 CA--C 1.544 0.727 0 C-N-CA 123.108 0.563 . . . . 0.0 110.28 168.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -65.8 139.81 58.84 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 122.206 1.937 . . . . 0.0 109.744 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -135.7 115.6 13.11 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 18.9 tpp85 -141.29 37.51 1.71 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.549 1.14 . . . . 0.0 108.466 168.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.9 mt -84.71 136.67 33.62 Favored 'General case' 0 C--O 1.235 0.294 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 169.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 119' ' ' SER . 53.5 t -55.58 133.88 50.63 Favored 'General case' 0 N--CA 1.447 -0.591 0 C-N-CA 126.213 1.805 . . . . 0.0 109.222 167.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 31.1 tp -68.53 -45.74 71.41 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.008 0.923 . . . . 0.0 110.63 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 17.1 m -72.21 -50.64 35.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-O 117.302 -1.333 . . . . 0.0 112.044 -174.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 19.9 p -103.4 -29.83 10.96 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 120.437 1.471 . . . . 0.0 113.591 -169.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.55 69.5 1.38 Allowed Glycine 0 CA--C 1.527 0.827 0 N-CA-C 110.014 -1.234 . . . . 0.0 110.014 -169.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -142.74 167.88 21.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 128.144 2.578 . . . . 0.0 106.318 169.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 88.8 mt -66.78 111.28 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 120.073 1.306 . . . . 0.0 107.645 176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.07 155.16 40.61 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.636 1.175 . . . . 0.0 110.213 171.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.72 -47.38 69.52 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 165.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.75 -160.14 23.82 Favored Glycine 0 CA--C 1.524 0.596 0 C-N-CA 124.864 1.221 . . . . 0.0 110.538 -169.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -77.08 130.19 37.05 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 169.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.3 m-70 -138.62 136.37 35.87 Favored 'General case' 0 N--CA 1.456 -0.148 0 C-N-CA 124.909 1.283 . . . . 0.0 109.167 167.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 50.82 49.22 21.47 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.606 1.562 . . . . 0.0 109.549 -165.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 62.56 13.7 46.33 Favored Glycine 0 CA--C 1.533 1.209 0 C-N-CA 126.468 1.985 . . . . 0.0 115.671 168.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.7 m -140.24 164.9 21.91 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 126.451 1.9 . . . . 0.0 107.867 169.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.04 121.7 12.5 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.225 0.921 . . . . 0.0 109.604 176.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . 0.428 ' HA ' ' SG ' ' A' ' 103' ' ' CYS . 57.7 m -153.79 143.69 21.93 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 123.762 0.825 . . . . 0.0 111.126 173.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.5 m -62.54 163.07 9.4 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 125.071 1.349 . . . . 0.0 112.026 175.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -59.06 -45.69 90.13 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.089 0.956 . . . . 0.0 109.913 167.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.16 -42.61 84.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.284 1.034 . . . . 0.0 111.144 -176.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 73.2 m -53.95 -50.61 66.11 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.979 1.312 . . . . 0.0 111.55 169.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.0 ttpp -53.81 -51.87 62.15 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.723 0.809 . . . . 0.0 111.224 171.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.76 -43.82 77.05 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 119.056 0.844 . . . . 0.0 111.352 -178.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 10.4 t80 -70.17 -41.62 73.54 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.772 -0.58 . . . . 0.0 111.893 177.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -56.17 -48.36 76.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.174 0.99 . . . . 0.0 110.947 174.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.1 mtpp -48.88 -60.85 2.41 Favored 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 124.959 1.304 . . . . 0.0 110.481 168.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 49.8 mtp85 -51.99 -48.69 64.29 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 119.092 0.86 . . . . 0.0 112.017 -179.171 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 63.5 m -49.42 -58.5 5.02 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.126 1.37 . . . . 0.0 110.342 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 82.3 mt -78.52 -58.95 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 C-N-CA 124.157 0.983 . . . . 0.0 109.218 -169.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -66.51 -38.28 86.88 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.425 1.09 . . . . 0.0 109.561 -169.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -75.35 -2.42 67.62 Favored Glycine 0 CA--C 1.531 1.065 0 C-N-CA 124.912 1.244 . . . . 0.0 113.768 174.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.251 0.1 OUTLIER 29.94 64.88 0.14 Allowed 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 129.211 3.004 . . . . 0.0 111.966 -168.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 48.4 mm -59.69 141.44 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 124.337 1.055 . . . . 0.0 108.638 176.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -73.75 100.8 3.51 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 106.407 -1.701 . . . . 0.0 106.407 167.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 16.1 m-85 -62.16 122.7 16.22 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 123.753 0.821 . . . . 0.0 109.982 -168.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.5 m -147.42 163.47 36.4 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 126.214 1.806 . . . . 0.0 109.071 -169.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.4 t -133.43 143.38 47.8 Favored Pre-proline 0 CA--C 1.539 0.539 0 C-N-CA 126.776 2.03 . . . . 0.0 107.398 177.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_exo -56.37 -38.23 95.59 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.434 2.756 . . . . 0.0 111.665 166.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -101.41 -106.28 0.24 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.562 1.545 . . . . 0.0 109.524 -170.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 17.9 p -132.71 11.92 4.4 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.678 1.191 . . . . 0.0 112.928 -166.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 44.29 69.36 0.43 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.529 1.932 . . . . 0.0 111.432 -167.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -141.26 -5.91 1.08 Allowed 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 125.821 1.649 . . . . 0.0 110.766 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 24.6 m -63.45 125.17 23.3 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 126.583 1.953 . . . . 0.0 111.896 -167.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -73.75 122.31 22.19 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 166.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 46.8 mm -70.13 142.48 15.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -174.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.476 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 73.3 p -131.33 173.06 11.45 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 127.152 2.181 . . . . 0.0 107.702 173.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -49.57 -45.53 47.84 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 124.032 0.933 . . . . 0.0 111.183 169.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 43.6 tpt85 -60.7 -59.78 4.84 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.241 0.616 . . . . 0.0 111.846 171.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.476 ' HB2' ' H ' ' A' ' 148' ' ' THR . 98.0 mtt180 -64.76 -21.34 66.74 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 118.022 -0.99 . . . . 0.0 112.356 -168.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 26.4 ttm180 -38.43 -51.19 1.56 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.379 1.472 . . . . 0.0 109.972 167.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 17.6 tptp -67.39 -32.49 73.42 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.957 0.903 . . . . 0.0 112.169 -172.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 38.6 m -90.14 -81.17 0.3 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.959 0.903 . . . . 0.0 111.724 -166.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 51.0 m -69.9 143.23 52.82 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 124.468 1.107 . . . . 0.0 111.899 -165.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -105.4 -50.16 3.28 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.95 0.9 . . . . 0.0 109.606 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.88 -50.02 74.72 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.367 1.067 . . . . 0.0 110.911 174.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 22.2 m -60.47 -40.94 93.08 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.989 0.916 . . . . 0.0 111.108 -179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 48.7 tpt85 -56.81 -55.64 31.75 Favored 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 123.229 0.612 . . . . 0.0 109.797 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 56.6 t80 -58.93 -46.95 86.71 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.472 1.109 . . . . 0.0 110.872 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 15.1 tmm? -50.54 -59.65 3.82 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.491 1.517 . . . . 0.0 110.457 170.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -59.24 -48.88 79.97 Favored 'General case' 0 N--CA 1.462 0.14 0 C-N-CA 123.799 0.84 . . . . 0.0 109.319 -172.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -45.87 -62.63 1.23 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.959 1.704 . . . . 0.0 110.709 174.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 36.0 mt -59.19 -45.5 90.91 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.381 0.672 . . . . 0.0 110.907 -177.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.9 tttt -54.69 -55.23 31.91 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 124.999 1.32 . . . . 0.0 110.717 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.8 m -65.6 -42.12 92.18 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-N 118.545 0.611 . . . . 0.0 110.787 -178.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 137.49 18.92 0.61 Allowed Glycine 0 CA--C 1.528 0.844 0 CA-C-O 118.562 -1.132 . . . . 0.0 113.263 169.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -71.95 94.48 1.46 Allowed 'General case' 0 C--O 1.234 0.286 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 167.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.3 mt -69.34 127.34 32.69 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 -177.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.8 -36.14 76.13 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 123.145 0.578 . . . . 0.0 111.628 179.217 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -62.72 -15.72 54.21 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.261 1.024 . . . . 0.0 113.057 175.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.84 -41.12 82.91 Favored Glycine 0 CA--C 1.53 0.984 0 C-N-CA 124.212 0.91 . . . . 0.0 112.086 169.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.61 114.93 4.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 171.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 1.7 mtp-105 -87.29 127.79 35.18 Favored 'General case' 0 N--CA 1.462 0.147 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -175.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.05 -33.33 70.64 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 125.972 1.709 . . . . 0.0 111.271 179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -59.74 -24.68 64.23 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.854 1.661 . . . . 0.0 111.976 177.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 52.77 60.22 3.94 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 125.318 1.447 . . . . 0.0 110.806 168.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 29.4 m -126.18 159.0 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 127.179 2.192 . . . . 0.0 106.276 169.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 59.3 mtt180 -77.25 -179.22 5.53 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.144 -0.972 . . . . 0.0 112.313 -168.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 44.99 65.94 1.64 Allowed Glycine 0 C--N 1.336 0.552 0 C-N-CA 127.401 2.429 . . . . 0.0 114.737 166.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -117.96 62.62 0.42 Allowed Glycine 0 C--N 1.334 0.423 0 N-CA-C 107.97 -2.052 . . . . 0.0 107.97 167.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -54.11 122.59 10.53 Favored 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.21 0.604 . . . . 0.0 111.085 -166.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 12.0 tp-100 -89.06 86.69 6.97 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.427 0.691 . . . . 0.0 110.34 -166.154 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -91.08 111.18 22.53 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 167.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -68.75 140.98 55.36 Favored 'General case' 0 C--O 1.238 0.475 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 167.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 21.3 pttm . . . . . 0 C--O 1.235 0.318 0 C-N-CA 124.595 1.158 . . . . 0.0 109.631 -178.375 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.283 0 O4'-C1'-N19 110.936 3.92 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.049 0 O4'-C1'-N19 110.385 3.231 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.598 0 P-O3'-C3' 123.448 3.124 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.952 1 O4'-C1'-N19 112.762 6.203 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 1 O4'-C1'-N19 113.037 6.546 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.11 1 O4'-C1'-N19 112.422 5.777 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 114.697 8.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 0 O4'-C1'-N19 110.898 3.872 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 113.238 6.797 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 0 O4'-C1'-N19 110.919 3.899 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.681 0 O4'-C1'-N19 110.287 3.109 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.435 0 O4'-C1'-N19 110.715 3.643 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.37 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.915 1 O4'-C1'-N19 111.475 4.593 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.449 1 O4'-C1'-N19 111.595 4.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.729 0 O4'-C1'-N19 110.377 3.221 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.368 0 O4'-C1'-N19 110.528 3.41 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.904 1 O4'-C1'-N19 112.307 5.633 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.962 1 O4'-C1'-N19 111.073 4.092 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.29 0 O4'-C1'-N19 110.506 3.383 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.57 0 P-O3'-C3' 124.123 3.686 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.663 1 O4'-C1'-N19 112.593 5.991 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 0 P-O3'-C3' 123.186 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.802 0 O4'-C1'-N19 110.303 3.129 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -62.25 149.1 88.07 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 122.946 0.498 . . . . 0.0 110.453 169.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.89 153.93 63.49 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 122.421 2.081 . . . . 0.0 109.896 167.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.8 mttt -134.07 141.48 47.19 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 124.66 1.184 . . . . 0.0 108.45 175.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -69.3 140.91 54.41 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 -174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.5 tp -85.37 140.45 30.76 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 168.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 44.8 t -57.03 128.85 39.04 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 124.524 1.13 . . . . 0.0 108.377 167.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 54.5 tp -62.69 -43.53 98.58 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.707 1.203 . . . . 0.0 111.374 175.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 21.4 t -74.87 -70.95 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 123.88 0.872 . . . . 0.0 110.484 -168.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.8 p -79.9 -77.58 0.18 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.837 1.199 . . . . 0.0 108.83 -177.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 133.55 75.9 0.1 OUTLIER Glycine 0 CA--C 1.521 0.468 0 N-CA-C 109.563 -1.415 . . . . 0.0 109.563 -169.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 44.5 t0 -148.07 170.77 17.06 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.886 2.074 . . . . 0.0 106.356 167.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 95.2 mt -58.38 118.42 2.33 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 CA-C-N 119.994 1.27 . . . . 0.0 107.952 170.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.5 139.68 51.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 123.686 0.794 . . . . 0.0 109.028 169.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 6.9 p -59.98 -42.28 93.85 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.128 0.971 . . . . 0.0 111.074 168.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.89 -152.35 10.75 Favored Glycine 0 CA--C 1.524 0.612 0 N-CA-C 110.458 -1.057 . . . . 0.0 110.458 169.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -64.83 127.66 32.48 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 168.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 45.5 m80 -137.17 135.52 37.39 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 124.985 1.314 . . . . 0.0 109.453 167.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 39.01 51.96 1.95 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 128.202 2.601 . . . . 0.0 110.932 -167.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.95 9.56 71.26 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 126.095 1.807 . . . . 0.0 115.52 168.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.2 m -134.85 167.93 24.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 119.476 1.638 . . . . 0.0 108.84 169.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -65.62 116.4 6.82 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 120.846 -1.159 . . . . 0.0 108.892 169.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 73.1 m -153.01 144.77 23.55 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.63 0.772 . . . . 0.0 110.306 171.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 25.5 p -70.18 173.12 7.02 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 122.271 1.034 . . . . 0.0 112.176 -178.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -54.56 -42.06 70.54 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 125.061 1.344 . . . . 0.0 111.732 171.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.47 -50.92 65.58 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 118.424 0.556 . . . . 0.0 110.217 -174.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 96.0 m -52.23 -54.83 26.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.392 171.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 4.6 tmmm? -47.68 -56.36 7.46 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.045 0.938 . . . . 0.0 110.251 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.6 -51.94 67.66 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.911 1.284 . . . . 0.0 111.185 -175.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -54.0 -54.37 40.05 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.483 1.113 . . . . 0.0 110.694 177.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -61.28 -49.53 76.67 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.529 1.132 . . . . 0.0 110.359 -173.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -45.99 -64.73 0.67 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.895 1.678 . . . . 0.0 110.345 169.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.3 mtp85 -55.75 -45.45 78.06 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 118.673 -0.679 . . . . 0.0 111.226 -174.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 71.2 m -51.68 -53.04 43.35 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.819 0.847 . . . . 0.0 110.508 178.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 78.5 mt -76.02 -49.37 25.92 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -169.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -51.1 -49.55 60.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.811 0.845 . . . . 0.0 110.528 174.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.78 -0.0 89.84 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.911 1.243 . . . . 0.0 113.457 -174.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.7 p30 35.43 50.63 0.57 Allowed 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 127.253 2.221 . . . . 0.0 111.753 -167.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.5 mt -75.64 143.19 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 -175.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -119.25 153.17 35.42 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 125.046 1.338 . . . . 0.0 108.486 172.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 35.2 m-85 -136.69 167.32 21.65 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.996 1.318 . . . . 0.0 110.672 -168.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 51.0 m -149.68 148.97 29.91 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 128.09 2.556 . . . . 0.0 106.609 179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 19.7 m -124.47 148.07 57.38 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.097 1.359 . . . . 0.0 108.664 169.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -69.71 -18.97 36.95 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 123.834 3.023 . . . . 0.0 113.626 -166.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -142.99 167.27 22.45 Favored 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 127.28 2.232 . . . . 0.0 106.674 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 2.1 p -78.62 74.42 5.16 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 127.616 2.367 . . . . 0.0 110.031 -169.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 41.53 69.92 0.31 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 127.518 2.327 . . . . 0.0 112.645 -169.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 20.2 mm-40 -73.36 -31.56 64.01 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 164.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 13.8 m -58.12 132.63 54.11 Favored 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 128.125 2.57 . . . . 0.0 110.972 -171.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 43.0 tt0 -126.41 112.01 15.13 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 105.412 -2.069 . . . . 0.0 105.412 168.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 18.3 mm -71.58 109.85 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.173 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -168.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 5.7 p -141.34 149.84 41.68 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 128.442 2.697 . . . . 0.0 104.895 170.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -49.46 -36.0 21.32 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -166.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 48.5 mtm105 -66.49 -74.97 0.1 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 123.378 0.671 . . . . 0.0 110.754 169.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 -60.37 -27.77 67.66 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 125.289 1.435 . . . . 0.0 112.567 -167.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ttt85 -36.26 -51.05 0.77 Allowed 'General case' 0 C--O 1.224 -0.263 0 C-N-CA 126.979 2.111 . . . . 0.0 111.161 167.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 58.0 mttp -64.85 -31.42 72.65 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 119.095 0.862 . . . . 0.0 112.04 -171.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.0 m -69.02 -33.35 73.49 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.37 1.068 . . . . 0.0 112.265 174.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.8 t -76.16 160.51 29.65 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.326 1.45 . . . . 0.0 110.521 175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -131.96 -61.73 0.87 Allowed 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 125.415 1.486 . . . . 0.0 108.136 167.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.3 -52.49 22.5 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 124.516 1.126 . . . . 0.0 111.555 -168.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.6 m -63.93 -27.8 69.39 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.54 0.736 . . . . 0.0 111.488 -169.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 42.0 mtp180 -48.16 -60.35 2.7 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.292 1.437 . . . . 0.0 110.455 170.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -66.25 -43.55 86.2 Favored 'General case' 0 C--O 1.234 0.259 0 C-N-CA 123.413 0.685 . . . . 0.0 110.017 -171.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 47.6 tpp -51.81 -53.42 40.33 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.406 1.082 . . . . 0.0 111.244 171.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -58.87 -50.79 72.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-O 118.319 -0.848 . . . . 0.0 109.151 -179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.68 -56.06 13.63 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.114 0.965 . . . . 0.0 110.949 -178.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.6 mt -48.57 -55.59 10.71 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.225 1.41 . . . . 0.0 111.696 172.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -57.8 -55.83 29.78 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 124.285 1.034 . . . . 0.0 110.787 -174.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 27.1 m -71.79 -44.24 68.52 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-O 118.861 -0.59 . . . . 0.0 111.56 -168.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -163.28 -67.14 0.02 OUTLIER Glycine 0 C--N 1.342 0.876 0 CA-C-O 118.33 -1.261 . . . . 0.0 113.932 -167.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 44.9 mtm -67.25 99.94 0.75 Allowed 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 118.318 1.059 . . . . 0.0 108.759 -169.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . 0.438 HD12 ' CE1' ' A' ' 185' ' ' TYR . 5.3 mt -82.91 148.63 27.56 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 124.421 1.088 . . . . 0.0 109.034 178.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -38.94 -56.43 1.4 Allowed 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.201 1.8 . . . . 0.0 110.621 177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -50.1 -25.3 3.35 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 127.35 2.26 . . . . 0.0 114.735 -170.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -47.1 -52.78 11.82 Favored Glycine 0 CA--C 1.532 1.13 0 C-N-CA 124.057 0.836 . . . . 0.0 111.733 168.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 26.3 t -82.61 134.98 25.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 169.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -140.54 154.64 46.61 Favored 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 123.81 0.844 . . . . 0.0 109.172 169.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -72.02 -18.8 61.93 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.534 0.734 . . . . 0.0 111.6 -171.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -64.58 -15.08 60.49 Favored 'General case' 0 N--CA 1.469 0.479 0 C-N-CA 125.064 1.346 . . . . 0.0 112.049 169.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 60.0 mtp180 50.29 60.16 4.04 Favored 'General case' 0 C--N 1.345 0.403 0 C-N-CA 126.476 1.91 . . . . 0.0 111.227 165.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 46.4 t -90.27 92.02 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -169.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 20.6 ttp180 -55.33 138.03 46.43 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.793 0.837 . . . . 0.0 109.735 173.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 61.79 12.5 35.31 Favored Glycine 0 CA--C 1.532 1.115 0 CA-C-O 118.427 -1.207 . . . . 0.0 115.423 -171.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.27 75.26 2.39 Favored Glycine 0 C--N 1.339 0.745 0 CA-C-N 119.828 1.814 . . . . 0.0 109.87 -177.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 7.5 mtm180 -51.55 119.2 3.91 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.113 2.165 . . . . 0.0 110.424 -167.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -63.52 136.84 57.85 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 11.2 tppt? -141.8 113.77 8.0 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 106.531 -1.655 . . . . 0.0 106.531 168.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . 0.438 ' CE1' HD12 ' A' ' 169' ' ' LEU . 71.4 m-85 -65.88 164.85 14.1 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 122.797 0.439 . . . . 0.0 110.354 170.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 65.2 tttp . . . . . 0 C--O 1.235 0.329 0 C-N-CA 124.776 1.23 . . . . 0.0 109.944 -169.196 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . 0.401 " H1'" ' C6 ' ' B' ' 2' ' ' ' DC' . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 114.084 7.855 . . . . 0.0 . . . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . 0.401 ' C6 ' " H1'" ' B' ' 1' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.535 2.985 1 O4'-C1'-N19 112.642 6.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C4'-C3' 107.889 2.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.13 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.19 1 O4'-C1'-N19 114.154 7.943 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.521 0 O4'-C1'-N19 110.046 2.807 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.023 1 O4'-C1'-N19 114.141 7.926 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.819 1 O4'-C1'-N19 111.123 4.153 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 112.852 6.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.969 1 O4'-C1'-N19 111.306 4.382 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 0 O4'-C1'-N19 110.53 3.413 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.271 2 O4'-C1'-N19 112.699 6.123 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.4 0 O4'-C1'-N19 110.101 2.877 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 0 O4'-C1'-N19 110.741 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 0 P-O3'-C3' 123.027 2.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.258 0 O4'-C1'-N19 110.445 3.307 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C4'-C3' 108.898 3.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.173 0 O4'-C4'-C3' 108.495 2.895 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 111.067 4.084 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.571 0 O4'-C4'-C3' 108.549 2.949 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.605 1 O4'-C1'-N19 111.183 4.229 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 112.027 5.283 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.462 1 O4'-C1'-N19 114.342 8.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.956 0 O4'-C1'-N19 110.46 3.325 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.02 0 O4'-C1'-N19 110.275 3.094 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 0 O4'-C1'-N19 110.576 3.47 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.381 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.34 149.24 95.03 Favored Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 123.236 0.614 . . . . 0.0 110.855 177.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -74.43 150.98 41.96 Favored 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 122.672 2.248 . . . . 0.0 109.818 167.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.38 129.72 22.39 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.08 1.352 . . . . 0.0 107.591 170.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -79.5 115.18 18.97 Favored 'General case' 0 C--O 1.232 0.165 0 N-CA-C 107.237 -1.394 . . . . 0.0 107.237 -173.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -142.44 116.56 9.45 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 -168.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 41.9 t -65.05 125.05 23.72 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 124.969 1.308 . . . . 0.0 109.108 -173.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.0 mp -61.48 -31.82 71.8 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.785 0.834 . . . . 0.0 110.944 -178.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 23.1 t -72.69 -75.14 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 124.196 0.998 . . . . 0.0 109.233 -174.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.4 p -88.13 -19.58 26.8 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -168.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.14 64.02 3.48 Favored Glycine 0 CA--C 1.527 0.813 0 N-CA-C 109.356 -1.498 . . . . 0.0 109.356 -169.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.1 t0 -138.94 159.27 42.54 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 126.768 2.027 . . . . 0.0 107.39 172.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.5 mt -65.16 112.88 1.77 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.325 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 -171.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.93 141.12 51.14 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 175.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.5 p -67.69 -44.75 77.02 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.931 -0.396 . . . . 0.0 109.931 168.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -170.09 -179.23 41.54 Favored Glycine 0 C--N 1.337 0.584 0 C-N-CA 123.667 0.651 . . . . 0.0 111.623 -168.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -74.57 130.97 40.55 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 168.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -145.44 140.85 27.88 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 165.059 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 51.56 50.68 18.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 124.404 1.081 . . . . 0.0 109.109 -166.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 56.01 16.75 14.15 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 126.202 1.858 . . . . 0.0 116.652 167.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.8 m -140.79 159.97 23.93 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 126.381 1.872 . . . . 0.0 107.627 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.56 128.82 38.99 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 169.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 14.5 p -149.73 152.63 35.6 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 124.137 0.975 . . . . 0.0 109.798 176.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.8 m -67.38 164.16 19.21 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 121.413 -0.804 . . . . 0.0 111.092 170.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -58.52 -42.43 87.74 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 123.153 0.581 . . . . 0.0 109.844 167.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -58.21 -53.34 59.33 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.111 0.964 . . . . 0.0 110.943 178.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 59.7 m -58.3 -50.07 74.92 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 126.143 1.777 . . . . 0.0 110.963 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 3.9 tmmm? -48.53 -57.83 5.57 Favored 'General case' 0 C--N 1.339 0.11 0 C-N-CA 124.442 1.097 . . . . 0.0 109.997 169.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -60.51 -45.01 95.38 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.283 1.033 . . . . 0.0 111.335 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.4 t80 -52.01 -59.47 4.31 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.447 1.099 . . . . 0.0 111.025 169.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -59.18 -48.9 79.91 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.796 0.838 . . . . 0.0 110.481 -172.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -45.23 -67.22 0.3 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 127.213 2.205 . . . . 0.0 110.492 168.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 -54.33 -44.63 72.23 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 118.591 -0.718 . . . . 0.0 110.861 -175.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 52.5 m -52.12 -57.57 9.2 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.463 0.705 . . . . 0.0 110.247 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 70.3 mt -77.42 -53.26 14.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -169.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -62.91 -33.27 74.97 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.512 0.725 . . . . 0.0 111.142 -175.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -90.09 -0.88 76.8 Favored Glycine 0 CA--C 1.533 1.211 0 C-N-CA 125.7 1.619 . . . . 0.0 114.192 177.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.2 48.0 1.49 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.323 2.249 . . . . 0.0 113.309 -169.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.1 mt -73.36 148.84 8.49 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.607 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 169.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -132.8 157.62 44.53 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 125.138 1.375 . . . . 0.0 108.909 172.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -137.34 170.02 16.8 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 125.729 1.612 . . . . 0.0 109.785 -169.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.9 m -147.18 148.51 31.6 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.548 1.539 . . . . 0.0 108.874 173.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 29.5 m -127.74 152.64 77.29 Favored Pre-proline 0 CA--C 1.542 0.648 0 C-N-CA 127.268 2.227 . . . . 0.0 106.75 167.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -68.46 -23.19 37.88 Favored 'Trans proline' 0 CA--C 1.537 0.63 0 C-N-CA 123.19 2.594 . . . . 0.0 113.515 -167.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -128.79 -150.85 0.45 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.577 1.551 . . . . 0.0 109.223 -169.112 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 10.5 p -128.3 78.21 1.82 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 125.774 1.63 . . . . 0.0 108.178 -168.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 2.2 t30 46.96 55.05 8.43 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.767 2.027 . . . . 0.0 111.692 -172.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -80.87 -31.92 35.11 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 164.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 30.4 m -52.63 134.75 35.63 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.698 1.599 . . . . 0.0 108.846 167.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -129.39 125.92 37.66 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 169.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 16.2 mm -83.28 133.79 28.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 -168.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.9 p -132.15 175.91 8.84 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.05 1.74 . . . . 0.0 106.941 167.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 73.0 tttt -49.17 -47.04 46.14 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 121.228 -0.92 . . . . 0.0 111.757 172.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -66.16 -60.53 2.72 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.519 0.728 . . . . 0.0 110.192 174.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 83.3 mtt85 -65.95 -16.83 64.23 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 118.416 -0.802 . . . . 0.0 112.815 -167.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.6 ttm180 -39.04 -62.17 0.67 Allowed 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 125.91 1.684 . . . . 0.0 109.581 167.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -60.36 -41.63 94.08 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.089 0.555 . . . . 0.0 111.129 -174.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 11.9 m -63.22 -54.35 38.81 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 124.599 1.16 . . . . 0.0 110.281 -174.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 7.9 t -73.21 162.36 29.48 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.003 0.921 . . . . 0.0 110.528 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -140.73 -58.39 0.52 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.884 1.273 . . . . 0.0 109.163 168.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -63.81 -52.36 60.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 118.203 0.456 . . . . 0.0 110.466 -174.234 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.8 m -70.0 -28.47 65.53 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 119.049 -0.5 . . . . 0.0 110.31 -179.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -52.39 -55.93 18.41 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 123.981 0.912 . . . . 0.0 109.259 169.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -60.86 -45.5 94.28 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.51 1.124 . . . . 0.0 111.675 178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 8.3 tmm? -53.99 -53.11 57.39 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.946 0.898 . . . . 0.0 110.188 175.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 59.7 tttp -59.82 -45.88 91.0 Favored 'General case' 0 C--O 1.225 -0.222 0 CA-C-O 118.076 -0.964 . . . . 0.0 109.775 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.44 -57.21 7.39 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.598 0.759 . . . . 0.0 111.101 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.4 mt -49.52 -54.9 15.45 Favored 'General case' 0 N--CA 1.465 0.297 0 C-N-CA 123.954 0.902 . . . . 0.0 111.713 171.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -56.24 -54.44 45.22 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.609 1.164 . . . . 0.0 111.108 -174.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.8 m -65.0 -40.87 90.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 118.405 0.548 . . . . 0.0 110.564 -173.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.9 10.68 0.09 OUTLIER Glycine 0 C--N 1.34 0.795 0 CA-C-O 117.76 -1.578 . . . . 0.0 115.461 167.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 94.2 mtp -74.65 92.03 2.4 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 120.299 2.05 . . . . 0.0 106.201 168.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.9 mt -84.39 139.46 32.23 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 -170.449 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -53.86 -33.87 57.67 Favored 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.484 0.714 . . . . 0.0 110.772 167.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -53.15 -26.49 17.11 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 125.672 1.589 . . . . 0.0 113.276 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.13 -40.58 98.21 Favored Glycine 0 CA--C 1.533 1.201 0 O-C-N 121.433 -0.792 . . . . 0.0 112.955 172.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 28.1 t -68.45 143.97 14.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 C-N-CA 124.059 0.944 . . . . 0.0 109.027 -179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -121.81 118.26 28.57 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 124.658 1.183 . . . . 0.0 108.385 167.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 31.6 tp -64.03 -16.56 61.92 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 125.056 1.342 . . . . 0.0 111.92 176.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -53.01 -27.16 18.05 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.815 2.046 . . . . 0.0 111.433 167.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 48.1 mtp180 53.57 60.06 3.93 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 125.382 1.473 . . . . 0.0 110.546 167.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 36.0 m -123.07 141.53 43.05 Favored 'Isoleucine or valine' 0 C--O 1.239 0.515 0 N-CA-C 105.029 -2.212 . . . . 0.0 105.029 168.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -69.12 164.93 21.42 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -167.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.45 59.82 8.58 Favored Glycine 0 CA--C 1.526 0.729 0 C-N-CA 124.473 1.035 . . . . 0.0 111.272 174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -77.25 55.46 3.62 Favored Glycine 0 CA--C 1.53 0.999 0 N-CA-C 110.82 -0.912 . . . . 0.0 110.82 172.295 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -60.35 119.8 8.65 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 125.72 1.608 . . . . 0.0 109.335 -169.113 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -152.29 142.86 22.74 Favored 'General case' 0 C--O 1.232 0.168 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.87 152.63 46.78 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.019 0.927 . . . . 0.0 108.606 171.155 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 29.4 m-85 -91.73 68.09 5.47 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 124.362 2.029 . . . . 0.0 110.049 -168.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 68.8 mttm . . . . . 0 C--N 1.316 -0.849 0 C-N-CA 129.209 3.004 . . . . 0.0 105.26 168.297 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.08 1 O4'-C1'-N19 111.396 4.494 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.971 0 P-O3'-C3' 123.5 3.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.988 0 O4'-C1'-N19 110.145 2.931 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.982 1 O4'-C1'-N19 111.988 5.236 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C1'-N19 110.35 3.188 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.324 1 O4'-C1'-N19 111.834 5.043 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 1 O4'-C1'-N19 111.224 4.28 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.582 0 P-O3'-C3' 123.963 3.553 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.671 1 O4'-C1'-N19 112.858 6.323 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.013 1 O4'-C1'-N19 112.025 5.281 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.607 0 O4'-C1'-N19 110.559 3.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 0 O4'-C1'-N19 110.533 3.417 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.343 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.857 3.821 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.844 0 O4'-C1'-N19 110.532 3.415 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.414 0 P-O3'-C3' 123.807 3.423 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.495 0 O4'-C1'-N19 110.464 3.33 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.152 0 P-O3'-C3' 123.156 2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.078 2 O4'-C1'-N19 111.827 5.034 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.657 0 O4'-C1'-N19 110.49 3.362 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.504 0 O4'-C1'-N19 110.418 3.273 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.348 1 O4'-C1'-N19 111.352 4.44 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.325 1 O4'-C1'-N19 112.652 6.065 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.429 0 P-O3'-C3' 122.702 2.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.698 0 O4'-C1'-N19 110.134 2.917 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.91 0 O4'-C1'-N19 110.552 3.44 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 mm -114.02 117.66 43.5 Favored Pre-proline 0 CA--C 1.537 0.471 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 169.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_exo -62.16 149.37 90.78 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.901 2.401 . . . . 0.0 112.17 167.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 26.6 pttm -56.83 144.89 31.38 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 168.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.4 mmp_? -64.46 124.08 20.88 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 8.3 tp -136.89 139.31 41.53 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.381 1.472 . . . . 0.0 107.042 -168.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.7 t -53.53 123.22 11.52 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.991 0.916 . . . . 0.0 109.099 173.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 49.2 tp -61.75 -39.3 91.11 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.828 1.251 . . . . 0.0 111.037 176.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 24.6 t -69.9 -81.85 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.663 0 C-N-CA 124.62 1.168 . . . . 0.0 109.905 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 3.8 p -78.65 -66.19 0.89 Allowed 'General case' 0 C--N 1.342 0.279 0 CA-C-N 119.898 1.226 . . . . 0.0 110.686 -169.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 123.46 75.94 0.32 Allowed Glycine 0 CA--C 1.521 0.419 0 N-CA-C 108.865 -1.694 . . . . 0.0 108.865 -177.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -145.24 159.4 43.08 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 126.267 1.827 . . . . 0.0 106.637 168.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 85.1 mt -61.06 120.52 7.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 -174.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.3 141.25 52.37 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.744 -169.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -62.0 -45.66 92.63 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.699 0.8 . . . . 0.0 109.62 167.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.1 -163.89 33.56 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 111.205 -0.758 . . . . 0.0 111.205 169.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 29.1 m-85 -60.96 129.93 43.87 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 168.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -140.58 127.27 20.33 Favored 'General case' 0 C--O 1.233 0.236 0 C-N-CA 125.673 1.589 . . . . 0.0 108.046 168.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 63.4 m-85 43.15 51.79 5.57 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.652 1.581 . . . . 0.0 111.75 -167.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 72.11 9.64 72.15 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 125.079 1.324 . . . . 0.0 115.591 166.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.57 156.12 37.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.361 1.464 . . . . 0.0 108.249 169.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -63.03 120.13 10.82 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 169.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 72.8 m -156.17 154.85 31.48 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 124.697 1.199 . . . . 0.0 109.946 174.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.32 166.09 10.6 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.303 1.041 . . . . 0.0 112.239 -178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -57.92 -48.56 79.52 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.693 1.197 . . . . 0.0 110.536 169.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -64.58 -46.92 80.64 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.745 0.818 . . . . 0.0 111.108 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.8 m -54.3 -54.34 41.6 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.485 1.514 . . . . 0.0 110.447 175.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -46.6 -56.45 6.05 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 125.313 1.445 . . . . 0.0 111.572 169.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.07 -52.76 63.13 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.749 0.82 . . . . 0.0 110.816 -175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -59.05 -52.25 66.57 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.097 0.559 . . . . 0.0 110.865 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -54.28 -53.1 58.29 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.25 1.02 . . . . 0.0 110.764 -178.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -49.32 -61.02 2.32 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 125.313 1.445 . . . . 0.0 111.039 173.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 22.7 mtp-105 -51.41 -49.08 62.3 Favored 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.643 0.777 . . . . 0.0 110.515 -176.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -52.25 -45.51 65.39 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.762 0.825 . . . . 0.0 110.579 -177.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 68.6 mt -73.75 -60.35 2.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 C-N-CA 124.121 0.969 . . . . 0.0 108.548 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -60.65 -36.67 79.26 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.005 0.522 . . . . 0.0 110.747 -171.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -88.04 -2.65 80.53 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.638 1.59 . . . . 0.0 113.745 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 38.96 49.06 1.51 Allowed 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 127.172 2.189 . . . . 0.0 112.238 -168.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 19.6 mt -79.39 125.27 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -168.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -78.99 137.33 37.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 169.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -132.68 177.56 7.53 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 125.711 1.604 . . . . 0.0 109.893 175.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 16.2 p -152.39 -178.02 6.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 125.992 1.717 . . . . 0.0 109.783 -168.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 51.2 t -146.93 148.39 32.55 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 128.089 2.556 . . . . 0.0 107.18 -173.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -71.91 -23.21 22.36 Favored 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.083 2.522 . . . . 0.0 111.95 167.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -113.18 -98.14 0.43 Allowed 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.554 1.542 . . . . 0.0 110.957 -168.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 31.3 p -123.94 -0.25 8.47 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 114.083 1.142 . . . . 0.0 114.083 -165.196 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.253 0.4 OUTLIER 49.43 22.67 0.75 Allowed 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.503 2.321 . . . . 0.0 114.696 -168.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -138.97 42.23 2.1 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.975 1.31 . . . . 0.0 108.359 168.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 72.8 m -63.74 143.56 57.75 Favored 'General case' 0 C--O 1.236 0.364 0 O-C-N 121.716 -0.615 . . . . 0.0 110.245 169.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -67.66 140.25 56.81 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 108.171 -1.048 . . . . 0.0 108.171 167.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.3 mm -101.05 139.77 21.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 59.8 p -137.88 179.09 6.64 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.187 1.795 . . . . 0.0 107.299 169.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 59.2 tptt -50.21 -34.48 22.97 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.218 1.007 . . . . 0.0 111.872 167.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.87 -60.72 2.24 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.52 0.728 . . . . 0.0 110.471 173.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 48.0 mmm-85 -63.65 -21.19 66.25 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -166.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -55.58 -13.35 1.54 Allowed 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 175.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 3.9 tttm -120.92 8.11 10.46 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 121.06 1.755 . . . . 0.0 113.956 169.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 26.1 m -68.19 -51.37 46.34 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 119.163 0.892 . . . . 0.0 109.198 166.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 11.3 m -125.0 173.74 8.47 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.044 1.738 . . . . 0.0 109.598 -168.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.5 mt-30 -124.53 -56.59 1.6 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.704 1.202 . . . . 0.0 108.765 -173.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.4 -43.28 75.09 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.099 0.959 . . . . 0.0 111.619 178.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 33.7 m -54.69 -36.71 64.96 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.998 1.719 . . . . 0.0 112.441 -177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 81.0 mtt180 -55.36 -60.01 4.0 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 109.177 -0.675 . . . . 0.0 109.177 174.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -62.53 -43.7 98.17 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.688 1.195 . . . . 0.0 110.126 -173.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 59.6 tpp -48.78 -63.75 1.0 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.809 1.244 . . . . 0.0 110.593 169.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -58.78 -45.91 88.75 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 118.399 -0.81 . . . . 0.0 109.734 -175.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.76 -56.6 7.02 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.817 1.247 . . . . 0.0 110.838 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.5 mt -53.77 -50.61 65.68 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.962 0.905 . . . . 0.0 112.99 172.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -53.16 -54.08 41.03 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 118.815 0.734 . . . . 0.0 110.607 179.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.6 m -71.77 -46.2 62.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.397 -169.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 154.67 22.5 0.04 OUTLIER Glycine 0 CA--C 1.528 0.898 0 CA-C-O 118.755 -1.025 . . . . 0.0 114.902 169.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -83.68 97.11 8.93 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 104.497 -2.409 . . . . 0.0 104.497 165.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -70.18 138.97 52.25 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmtp? -51.81 -46.82 64.42 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 122.949 0.499 . . . . 0.0 110.809 168.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -65.75 -7.99 18.79 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -59.4 -49.54 77.37 Favored Glycine 0 CA--C 1.531 1.067 0 N-CA-C 110.247 -1.141 . . . . 0.0 110.247 167.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 96.9 t -69.14 145.63 13.19 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 168.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -132.43 131.26 41.57 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.305 1.042 . . . . 0.0 108.97 178.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 10.7 mp -66.21 -21.22 66.3 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.532 1.133 . . . . 0.0 111.009 170.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -53.38 -32.4 49.24 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.122 1.369 . . . . 0.0 111.503 168.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 46.0 ttm-85 52.66 60.24 3.94 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.872 1.669 . . . . 0.0 111.12 167.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 32.6 m -121.78 131.09 73.9 Favored 'Isoleucine or valine' 0 C--O 1.234 0.242 0 N-CA-C 105.846 -1.909 . . . . 0.0 105.846 169.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -89.35 174.53 7.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -167.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 70.11 36.48 72.03 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 125.202 1.382 . . . . 0.0 114.816 168.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -68.63 173.09 34.43 Favored Glycine 0 CA--C 1.539 1.54 0 CA-C-N 118.827 1.313 . . . . 0.0 111.568 167.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -130.36 93.26 3.42 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 106.603 -1.628 . . . . 0.0 106.603 166.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 7.1 tp-100 -75.13 130.56 39.44 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.804 1.241 . . . . 0.0 108.799 -177.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 30.2 mmtm -139.72 114.02 9.06 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 104.279 -2.489 . . . . 0.0 104.279 166.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -65.48 152.59 43.61 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 122.344 1.069 . . . . 0.0 113.35 -166.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 15.6 pttp . . . . . 0 C--O 1.237 0.422 0 C-N-CA 128.98 2.912 . . . . 0.0 107.403 -170.0 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.028 1 O4'-C1'-N19 111.393 4.491 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.889 0 P-O3'-C3' 123.495 3.163 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.48 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.895 0 P-O3'-C3' 123.447 3.122 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.46 1 O4'-C1'-N19 111.458 4.572 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.541 0 O5'-C5'-C4' 114.373 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.047 2 P-O3'-C3' 127.399 6.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.109 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.864 1 O4'-C1'-N19 111.758 4.948 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.492 1 O4'-C1'-N19 112.705 6.131 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.745 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.48 1 O4'-C1'-N19 112.362 5.703 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.347 1 O4'-C1'-N19 112.508 5.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.964 1 O4'-C1'-N19 111.513 4.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.474 0 O5'-C5'-C4' 114.374 2.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.263 1 O4'-C1'-N19 111.175 4.218 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.867 0 O4'-C1'-N19 109.571 2.214 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.809 1 O4'-C1'-N19 112.627 6.034 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.004 1 O4'-C1'-N19 111.818 5.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C4'-C3' 108.505 2.905 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.265 0 O4'-C4'-C3' 108.678 3.078 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.502 0 P-O3'-C3' 123.699 3.333 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.307 1 O4'-C1'-N19 113.418 7.023 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.091 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.734 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.093 1 O4'-C1'-N19 112.123 5.404 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.443 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 47.8 pt -60.93 140.98 93.64 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.187 0.595 . . . . 0.0 110.557 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -59.86 155.26 44.8 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 123.212 2.608 . . . . 0.0 112.256 166.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 60.7 mttp -142.23 164.95 28.78 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 125.838 1.655 . . . . 0.0 108.386 -171.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 24.5 tpp180 -133.02 114.83 14.42 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -176.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 95.8 mt -84.13 152.48 24.28 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 122.822 0.449 . . . . 0.0 110.012 169.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 53.4 t -58.37 138.99 56.13 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 125.796 1.638 . . . . 0.0 108.674 166.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -63.42 -35.69 81.27 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.25 3.9 p -89.18 -69.22 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 CA-C-N 119.494 1.043 . . . . 0.0 110.659 -168.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.9 p -81.0 -72.13 0.44 Allowed 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 118.928 0.785 . . . . 0.0 109.576 -169.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 130.41 78.23 0.18 Allowed Glycine 0 CA--C 1.523 0.544 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 32.1 t0 -147.29 161.08 41.69 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 127.36 2.264 . . . . 0.0 106.052 167.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 87.1 mt -59.91 121.26 7.22 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 -178.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.67 131.19 47.17 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.029 0.932 . . . . 0.0 108.971 178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -67.32 -38.9 85.67 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 123.398 0.679 . . . . 0.0 110.887 168.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -176.72 176.2 47.86 Favored Glycine 0 C--N 1.339 0.734 0 CA-C-N 118.448 0.567 . . . . 0.0 111.976 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -72.26 132.37 43.96 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 168.767 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -141.99 145.38 34.38 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 124.551 1.141 . . . . 0.0 107.95 167.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 51.4 m-85 40.26 46.93 2.04 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.671 1.188 . . . . 0.0 110.243 -167.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.99 18.11 66.3 Favored Glycine 0 CA--C 1.533 1.165 0 C-N-CA 125.488 1.518 . . . . 0.0 115.036 172.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.39 144.73 27.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.894 1.847 . . . . 0.0 109.884 175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -60.53 121.38 12.0 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 123.122 0.569 . . . . 0.0 109.73 174.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 7.8 p -155.36 166.2 34.29 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.602 1.161 . . . . 0.0 110.981 -168.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -75.23 163.9 27.02 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.597 0.713 . . . . 0.0 111.223 168.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -61.64 -42.69 99.25 Favored 'General case' 0 N--CA 1.466 0.359 0 C-N-CA 124.45 1.1 . . . . 0.0 109.959 167.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -56.13 -48.61 75.9 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.8 1.24 . . . . 0.0 111.342 179.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 58.9 m -57.05 -58.14 9.47 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.72 1.608 . . . . 0.0 109.931 179.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -42.77 -58.86 2.17 Favored 'General case' 0 C--O 1.232 0.132 0 C-N-CA 125.228 1.411 . . . . 0.0 111.539 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -57.72 -55.61 32.68 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 123.557 0.743 . . . . 0.0 110.421 -173.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -67.8 -42.14 82.05 Favored 'General case' 0 CA--C 1.535 0.395 0 O-C-N 121.975 -0.453 . . . . 0.0 110.733 -172.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -55.43 -52.58 63.13 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 124.495 1.118 . . . . 0.0 111.044 174.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -49.09 -58.39 5.03 Favored 'General case' 0 C--N 1.342 0.252 0 C-N-CA 124.217 1.007 . . . . 0.0 110.392 172.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 70.3 mtt180 -54.58 -46.6 73.77 Favored 'General case' 0 N--CA 1.468 0.444 0 C-N-CA 123.483 0.713 . . . . 0.0 111.198 -175.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 58.4 m -54.21 -47.31 72.27 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.352 0.661 . . . . 0.0 110.3 179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 49.4 mt -77.05 -53.58 14.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 C-N-CA 123.659 0.784 . . . . 0.0 109.416 -173.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 24.6 mm-40 -57.37 -43.03 83.23 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.56 0.744 . . . . 0.0 110.36 -178.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -81.05 0.07 87.97 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 125.245 1.402 . . . . 0.0 113.717 179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 30.13 55.62 0.17 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.693 3.197 . . . . 0.0 112.325 -167.28 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.5 mt -80.01 124.58 38.23 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 106.633 -1.618 . . . . 0.0 106.633 -169.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -74.49 130.17 39.11 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 171.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 59.0 m-85 -135.34 139.53 44.36 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 125.367 1.467 . . . . 0.0 107.805 168.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.4 m -144.11 136.47 26.68 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 125.8 1.64 . . . . 0.0 107.558 174.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 31.8 t -63.21 140.4 97.68 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.355 0.662 . . . . 0.0 109.403 177.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -60.01 -35.73 92.08 Favored 'Trans proline' 0 N--CA 1.458 -0.57 0 C-N-CA 123.258 2.639 . . . . 0.0 111.905 166.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.23 -133.75 0.33 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.511 1.525 . . . . 0.0 110.078 -168.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 12.3 p -73.74 -9.21 58.42 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.542 1.937 . . . . 0.0 113.678 -167.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.99 47.25 25.07 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 111.845 -169.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -151.78 49.2 0.8 Allowed 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.288 1.035 . . . . 0.0 110.388 168.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.9 m -62.34 140.09 58.53 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.486 -0.759 . . . . 0.0 109.101 167.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -71.24 143.23 50.48 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 107.024 -1.473 . . . . 0.0 107.024 165.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.5 mm -121.69 119.97 60.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -175.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.417 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 36.3 p -128.41 176.95 7.32 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 127.9 2.48 . . . . 0.0 105.681 168.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -56.28 -44.05 79.4 Favored 'General case' 0 N--CA 1.47 0.549 0 O-C-N 120.995 -1.066 . . . . 0.0 112.064 -168.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -60.57 -56.32 22.78 Favored 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 123.543 0.737 . . . . 0.0 111.246 170.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.417 ' HB2' ' H ' ' A' ' 148' ' ' THR . 69.7 mtm180 -66.44 -12.72 58.66 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 113.769 1.026 . . . . 0.0 113.769 -168.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 60.9 mtp85 -48.39 -44.44 34.78 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 119.161 0.891 . . . . 0.0 110.614 165.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -64.22 -42.66 96.49 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 123.884 0.874 . . . . 0.0 111.459 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 19.6 m -62.37 -39.42 93.13 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 124.067 0.947 . . . . 0.0 111.223 -169.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 10.5 t -140.47 107.66 5.49 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.556 0.693 . . . . 0.0 110.503 169.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -60.04 -39.04 84.55 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 126.238 1.815 . . . . 0.0 111.232 172.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -68.06 -57.1 6.67 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 124.462 1.105 . . . . 0.0 109.987 -175.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 84.7 m -58.96 -37.16 76.15 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.81 0.844 . . . . 0.0 111.619 176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.14 8.52 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.275 0.943 . . . . 0.0 110.168 168.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -63.13 -46.05 89.08 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 122.875 0.47 . . . . 0.0 110.778 -175.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 55.7 tpp -55.89 -52.62 63.45 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.081 1.352 . . . . 0.0 110.795 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -58.74 -49.93 75.81 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 117.844 -1.074 . . . . 0.0 109.114 179.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -49.54 -55.97 11.52 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 124.295 1.038 . . . . 0.0 110.875 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 12.1 mt -50.76 -53.86 28.22 Favored 'General case' 0 C--O 1.233 0.221 0 C-N-CA 124.467 1.107 . . . . 0.0 112.059 172.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -54.75 -54.78 37.59 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 123.859 0.864 . . . . 0.0 110.905 -177.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 31.9 m -67.15 -40.12 84.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 CA-C-O 118.724 -0.655 . . . . 0.0 110.99 -171.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.9 12.24 0.07 OUTLIER Glycine 0 C--N 1.342 0.869 0 CA-C-O 118.097 -1.391 . . . . 0.0 116.272 168.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.58 92.71 2.94 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 120.244 2.022 . . . . 0.0 105.888 166.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 5.5 mt -72.88 131.65 42.51 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 177.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.63 -21.03 24.27 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 169.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -58.46 -27.55 64.5 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.806 1.243 . . . . 0.0 112.318 172.006 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -57.74 -48.35 82.39 Favored Glycine 0 CA--C 1.531 1.051 0 C-N-CA 124.498 1.047 . . . . 0.0 112.263 176.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 48.4 t -69.01 137.51 24.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.387 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 83.2 mtt85 -125.98 132.84 51.97 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 124.309 1.044 . . . . 0.0 108.389 -174.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 89.1 mt -62.48 -29.18 70.35 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.321 0.648 . . . . 0.0 110.322 167.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -68.24 -11.94 60.17 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.067 1.747 . . . . 0.0 112.267 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 63.2 mtm180 50.58 60.32 3.94 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 125.546 1.538 . . . . 0.0 111.016 166.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 25.1 t -89.84 95.53 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 -168.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -49.42 129.11 18.39 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 172.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 57.47 51.8 55.58 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 124.786 1.184 . . . . 0.0 113.631 171.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -70.67 176.69 35.35 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 166.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 58.2 mtt85 -132.1 127.62 36.42 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 167.645 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -126.72 128.38 46.58 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 125.707 1.603 . . . . 0.0 108.489 -177.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -142.78 116.38 9.17 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 167.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 98.4 m-85 -65.53 157.22 30.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 124.162 0.985 . . . . 0.0 110.577 -174.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 38.8 mttm . . . . . 0 C--O 1.238 0.461 0 C-N-CA 125.146 1.379 . . . . 0.0 109.228 -168.164 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.066 1 O4'-C1'-N19 113.833 7.541 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.028 1 O4'-C1'-N19 112.383 5.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.97 1 O4'-C1'-N19 111.536 4.67 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.396 0 O4'-C1'-N19 109.967 2.709 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.292 1 O4'-C1'-N19 111.158 4.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 1 O4'-C1'-N19 111.815 5.019 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.205 1 O4'-C1'-N19 112.193 5.491 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.227 0 O4'-C1'-N19 110.548 3.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.264 1 O4'-C1'-N19 111.015 4.019 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.252 1 O4'-C1'-N19 112.507 5.884 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.527 0 O4'-C1'-N19 110.417 3.271 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.782 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 0 O4'-C1'-N19 110.725 3.657 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.716 1 O4'-C1'-N19 114.511 8.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 112.24 5.549 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.408 1 O4'-C1'-N19 111.453 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.67 1 O4'-C1'-N19 111.926 5.157 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.833 1 O4'-C1'-N19 112.894 6.367 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.306 1 O4'-C1'-N19 113.161 6.702 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.762 1 O4'-C1'-N19 112.828 6.285 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C4'-C3' 108.327 2.727 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.85 0 O4'-C4'-C3' 108.299 2.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.699 1 O4'-C1'-N19 113.408 7.01 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.991 0 O4'-C1'-N19 110.122 2.902 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.798 0 O4'-C1'-N19 110.694 3.617 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.861 0 O4'-C1'-N19 110.469 3.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.441 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -58.11 141.97 80.95 Favored Pre-proline 0 CA--C 1.545 0.78 0 C-N-CA 123.018 0.527 . . . . 0.0 110.279 169.371 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -87.83 170.34 6.31 Favored 'Trans proline' 0 CA--C 1.535 0.546 0 C-N-CA 123.195 2.596 . . . . 0.0 111.559 169.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -65.12 141.8 58.58 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 166.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -143.45 -175.51 4.58 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 126.338 1.855 . . . . 0.0 107.602 -169.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 85.2 mt -59.8 154.09 19.15 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 166.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 36.8 t -54.82 128.65 34.0 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 168.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 63.6 mt -60.92 -48.16 83.09 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.123 0.969 . . . . 0.0 111.158 -167.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 3.8 m -62.68 -64.55 0.63 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 123.799 0.84 . . . . 0.0 111.444 -176.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -82.12 -32.18 30.26 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 113.552 0.945 . . . . 0.0 113.552 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.61 61.87 3.91 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 108.335 -1.906 . . . . 0.0 108.335 -167.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.0 t0 -134.12 161.21 35.52 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 126.003 1.721 . . . . 0.0 108.275 169.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 91.5 mt -62.97 114.69 1.74 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.42 141.19 58.61 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.843 0.857 . . . . 0.0 109.467 173.196 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.0 p -62.57 -47.28 84.56 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.066 0.946 . . . . 0.0 110.261 168.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.51 -176.9 45.95 Favored Glycine 0 C--N 1.338 0.674 0 N-CA-C 112.156 -0.378 . . . . 0.0 112.156 -173.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -60.66 128.64 37.56 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 169.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 48.0 m80 -146.29 126.04 13.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.625 1.97 . . . . 0.0 108.444 174.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 34.9 m-85 44.52 52.75 7.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.655 1.582 . . . . 0.0 111.242 -168.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 76.16 0.9 67.19 Favored Glycine 0 CA--C 1.534 1.228 0 N-CA-C 116.319 1.288 . . . . 0.0 116.319 166.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 5.0 m -134.69 162.4 38.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 119.487 1.644 . . . . 0.0 109.024 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.74 124.31 20.38 Favored 'General case' 0 C--O 1.236 0.387 0 O-C-N 121.698 -0.626 . . . . 0.0 109.35 169.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 15.7 m -150.41 159.49 44.43 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 124.054 0.942 . . . . 0.0 110.451 169.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 7.7 m -59.28 159.78 7.35 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.08 0.952 . . . . 0.0 112.035 170.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.19 -45.39 87.63 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.285 1.034 . . . . 0.0 109.84 168.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.62 -45.79 67.72 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.251 0.62 . . . . 0.0 111.321 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 78.0 m -52.71 -52.04 57.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.166 1.386 . . . . 0.0 110.735 171.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -48.88 -55.43 11.73 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 124.344 1.058 . . . . 0.0 111.336 169.116 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -61.69 -39.42 91.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.588 0.755 . . . . 0.0 111.945 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -61.56 -54.51 42.07 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 123.72 0.808 . . . . 0.0 111.071 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -55.72 -49.12 73.89 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.78 1.232 . . . . 0.0 110.507 -176.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -42.65 -65.35 0.48 Allowed 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 127.337 2.255 . . . . 0.0 110.41 168.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 57.8 mtt180 -59.29 -43.83 92.55 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 123.831 0.853 . . . . 0.0 110.565 -173.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 20.0 m -53.33 -53.3 52.99 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 123.661 0.784 . . . . 0.0 110.089 178.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 63.1 mt -74.91 -64.84 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 C-N-CA 123.864 0.866 . . . . 0.0 108.728 -173.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 -69.41 -31.3 69.56 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.383 0.673 . . . . 0.0 111.053 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.13 -4.13 88.5 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 124.867 1.222 . . . . 0.0 113.778 173.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.07 50.05 1.74 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 127.362 2.265 . . . . 0.0 112.956 -169.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 54.7 mt -81.56 124.91 39.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.159 -1.423 . . . . 0.0 107.159 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 71.9 mm-40 -85.18 147.07 26.79 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 123.921 0.888 . . . . 0.0 109.306 169.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -134.6 167.88 20.0 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.491 1.517 . . . . 0.0 109.734 176.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 48.8 m -141.51 168.78 18.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.169 2.187 . . . . 0.0 107.958 169.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 33.4 t -138.79 123.79 11.86 Favored Pre-proline 0 CA--C 1.539 0.557 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 167.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -65.8 -33.64 42.86 Favored 'Trans proline' 0 CA--C 1.535 0.545 0 C-N-CA 123.413 2.742 . . . . 0.0 113.812 -166.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -61.21 -68.8 0.28 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.496 1.119 . . . . 0.0 110.853 -169.1 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.4 p -138.41 -4.46 1.65 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.109 1.363 . . . . 0.0 111.608 -172.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 45.55 31.91 1.02 Allowed 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.436 2.294 . . . . 0.0 112.95 -168.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -163.73 119.46 1.65 Allowed 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 104.09 -2.559 . . . . 0.0 104.09 167.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -142.89 150.55 39.96 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 125.63 1.572 . . . . 0.0 110.129 -168.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -71.48 151.52 43.87 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 166.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 28.3 mm -124.08 141.95 42.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.402 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 69.9 p -133.41 170.42 15.51 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 126.855 2.062 . . . . 0.0 106.215 168.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.32 -31.05 65.28 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.847 -1.158 . . . . 0.0 113.145 173.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 85.4 mtt85 -65.13 -62.67 1.41 Allowed 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 118.531 0.605 . . . . 0.0 109.675 168.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.402 ' HB2' ' H ' ' A' ' 148' ' ' THR . 72.0 mtp85 -67.11 -17.37 64.84 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.168 0.987 . . . . 0.0 112.678 -169.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 6.3 tmm_? -45.11 -49.79 11.57 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 126.557 1.943 . . . . 0.0 111.643 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 62.3 mttp -57.79 -54.73 43.6 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.337 0.971 . . . . 0.0 111.151 175.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.7 m -58.01 -55.12 39.05 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.018 1.327 . . . . 0.0 111.536 -167.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 7.7 m -72.2 148.69 45.31 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.423 0.689 . . . . 0.0 110.831 175.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -137.29 -63.81 0.58 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 125.095 1.358 . . . . 0.0 108.63 -178.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -54.34 -57.2 12.17 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.741 0.816 . . . . 0.0 110.311 171.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 10.6 m -56.49 -40.66 75.33 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.469 1.508 . . . . 0.0 111.526 178.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 16.1 ttm180 -53.47 -56.98 12.41 Favored 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 124.263 1.025 . . . . 0.0 109.293 175.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -62.0 -46.97 86.89 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.01 0.924 . . . . 0.0 111.737 -179.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 88.7 mtp -55.88 -49.98 71.91 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 123.969 0.908 . . . . 0.0 110.563 178.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -59.11 -48.95 79.72 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-O 117.937 -1.03 . . . . 0.0 109.997 175.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -46.63 -55.14 8.14 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 125.326 1.45 . . . . 0.0 111.193 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.34 -56.35 8.34 Favored 'General case' 0 C--O 1.233 0.215 0 C-N-CA 124.903 1.281 . . . . 0.0 112.449 173.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -58.74 -52.69 64.61 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.289 0.635 . . . . 0.0 110.751 -177.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.2 m -66.67 -40.2 85.58 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 CA-C-N 118.426 0.557 . . . . 0.0 111.23 -169.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 153.49 6.02 0.1 Allowed Glycine 0 CA--C 1.529 0.95 0 CA-C-O 118.646 -1.085 . . . . 0.0 115.375 168.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.4 mtp -76.6 95.44 3.93 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 105.68 -1.971 . . . . 0.0 105.68 168.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 26.3 mt -84.1 139.88 32.17 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -169.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -51.96 -45.13 64.27 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.173 0.589 . . . . 0.0 110.898 169.292 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -61.01 -17.82 54.3 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.4 -48.14 71.5 Favored Glycine 0 CA--C 1.527 0.838 0 C-N-CA 124.031 0.824 . . . . 0.0 111.165 168.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 20.0 t -61.58 121.53 10.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -70.78 118.2 13.27 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 176.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.02 -40.49 85.14 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 168.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -69.31 -12.13 61.4 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.921 1.288 . . . . 0.0 112.706 178.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 59.72 60.3 2.26 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 126.342 1.857 . . . . 0.0 111.2 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 2.0 m -119.23 97.35 5.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 C-N-CA 125.598 1.559 . . . . 0.0 106.848 -170.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 29.1 ttm-85 -59.6 145.73 43.43 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.772 -166.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.62 29.28 57.63 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.597 1.094 . . . . 0.0 113.549 -174.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.74 72.29 2.43 Favored Glycine 0 C--N 1.338 0.649 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 171.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 182' ' ' ARG . 4.5 ptm180 -59.42 140.1 56.47 Favored 'General case' 0 C--O 1.235 0.328 0 C-N-CA 125.511 1.524 . . . . 0.0 111.812 -169.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 96.7 mm-40 -123.1 140.83 52.61 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 127.466 2.306 . . . . 0.0 109.215 -168.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -138.76 114.24 9.71 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 167.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -74.01 158.52 34.18 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 110.252 175.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? . . . . . 0 C--O 1.237 0.41 0 C-N-CA 126.322 1.849 . . . . 0.0 108.236 169.771 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.934 1 O4'-C1'-N19 114.045 7.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.818 1 O4'-C1'-N19 112.61 6.012 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.629 0 O4'-C4'-C3' 108.329 2.729 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.413 -2.976 0 C4'-C3'-O3' 118.548 3.749 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.606 2 P-O3'-C3' 126.602 5.751 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.786 1 O4'-C1'-N19 112.198 5.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.475 1 O4'-C1'-N19 114.002 7.752 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.64 0 O4'-C1'-N19 110.948 3.934 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.75 0 O4'-C1'-N19 109.794 2.493 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.065 1 O4'-C1'-N19 112.403 5.754 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.202 1 O4'-C1'-N19 113.335 6.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.203 1 O4'-C1'-N19 111.68 4.85 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.275 0 O4'-C1'-N19 110.795 3.744 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.033 1 O4'-C1'-N19 111.151 4.189 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.998 0 O4'-C1'-N19 110.024 2.78 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.769 1 O4'-C1'-N19 111.328 4.41 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.242 0 O4'-C1'-N19 109.889 2.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 1 O4'-C1'-N19 113.224 6.78 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.068 1 O4'-C1'-N19 111.481 4.602 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.815 0 O4'-C4'-C3' 108.463 2.863 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.401 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.443 0 P-O3'-C3' 123.462 3.135 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 113.604 7.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.614 0 O4'-C1'-N19 110.978 3.973 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.439 1 O4'-C1'-N19 111.807 5.009 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 0 O4'-C1'-N19 110.682 3.603 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.396 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.4 pt -66.32 153.84 91.75 Favored Pre-proline 0 CA--C 1.545 0.77 0 C-N-CA 123.095 0.558 . . . . 0.0 110.792 169.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_exo -60.18 161.64 19.08 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.956 2.437 . . . . 0.0 112.216 165.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -140.05 133.04 29.4 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 169.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -85.01 70.68 10.95 Favored 'General case' 0 CA--C 1.531 0.241 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 -177.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 21.3 tp -151.85 125.25 8.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 126.399 1.879 . . . . 0.0 106.223 -169.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 39.5 t -62.44 127.04 29.43 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 -177.341 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 9.9 mp -62.98 -35.06 78.92 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 122.72 0.408 . . . . 0.0 110.564 176.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.4 t -73.76 -80.34 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.562 0 C-N-CA 124.282 1.033 . . . . 0.0 109.227 -177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 5.1 p -83.31 -15.97 48.02 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 -168.125 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 71.86 15.62 76.1 Favored Glycine 0 CA--C 1.532 1.124 0 CA-C-O 119.311 -0.716 . . . . 0.0 112.94 -174.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 45.7 t0 -75.72 163.24 27.48 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.677 1.238 . . . . 0.0 107.978 165.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.0 mt -64.24 113.62 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 170.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.81 142.98 58.24 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 123.52 0.728 . . . . 0.0 109.365 170.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -62.92 -45.33 93.03 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.638 0.775 . . . . 0.0 110.534 168.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.29 -177.5 42.59 Favored Glycine 0 CA--C 1.525 0.693 0 C-N-CA 124.789 1.185 . . . . 0.0 110.739 -174.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -69.54 129.02 38.53 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 168.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.2 m80 -138.28 132.02 31.03 Favored 'General case' 0 CA--C 1.522 -0.116 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 170.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 50.21 47.6 23.41 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.482 1.513 . . . . 0.0 110.569 -167.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.0 4.38 67.3 Favored Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.381 1.467 . . . . 0.0 116.031 166.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 12.7 m -137.49 155.74 31.83 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 CA-C-N 119.763 1.782 . . . . 0.0 109.057 169.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.48 116.88 3.63 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.557 0.743 . . . . 0.0 109.645 174.469 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 6.6 m -148.69 138.47 22.1 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 124.801 1.241 . . . . 0.0 108.566 -175.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.7 m -61.05 163.59 5.86 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 121.865 0.84 . . . . 0.0 111.546 171.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -58.24 -42.32 86.08 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.761 1.224 . . . . 0.0 111.374 169.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.56 -53.25 59.74 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.45 0.7 . . . . 0.0 110.892 177.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 45.7 m -52.18 -54.05 35.57 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.921 1.689 . . . . 0.0 110.072 178.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.1 ttpt -46.23 -63.9 0.88 Allowed 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.08 1.352 . . . . 0.0 110.914 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.99 -44.12 91.54 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 124.721 1.209 . . . . 0.0 112.082 -169.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -54.04 -58.69 6.37 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 123.623 0.769 . . . . 0.0 111.1 171.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -58.41 -49.44 77.27 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.595 1.158 . . . . 0.0 109.862 -172.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -43.34 -66.15 0.41 Allowed 'General case' 0 C--O 1.233 0.216 0 C-N-CA 127.797 2.439 . . . . 0.0 110.969 169.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -55.77 -47.68 76.61 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 123.993 0.917 . . . . 0.0 110.812 -175.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 95.9 m -52.17 -53.27 45.21 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.336 1.054 . . . . 0.0 110.388 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 66.2 mt -70.27 -51.26 40.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.191 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -170.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -55.93 -42.4 76.06 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.963 0.905 . . . . 0.0 110.788 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -80.99 -2.56 90.49 Favored Glycine 0 CA--C 1.533 1.19 0 C-N-CA 125.082 1.325 . . . . 0.0 113.9 -179.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 40.25 42.61 1.24 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.329 2.252 . . . . 0.0 112.563 -167.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -74.66 145.71 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 175.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -133.48 160.29 37.85 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.025 1.33 . . . . 0.0 108.427 169.584 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 79.6 m-85 -139.89 166.01 25.79 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 125.644 1.578 . . . . 0.0 109.449 -169.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.2 m -144.93 135.16 24.08 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 126.206 1.802 . . . . 0.0 106.986 169.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 28.2 t -65.8 144.94 99.02 Favored Pre-proline 0 CA--C 1.542 0.652 0 C-N-CA 123.539 0.735 . . . . 0.0 109.508 178.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -72.37 -27.24 16.34 Favored 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 122.776 2.317 . . . . 0.0 111.25 167.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -102.95 -135.02 0.32 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.741 1.616 . . . . 0.0 109.313 -171.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 18.3 p -73.0 -14.54 61.45 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.738 1.615 . . . . 0.0 113.344 -168.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 52.64 46.86 25.91 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.456 1.902 . . . . 0.0 111.821 -169.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -152.47 25.04 0.6 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.122 0.969 . . . . 0.0 111.624 168.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 65.3 m -57.11 132.32 52.58 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 125.091 1.356 . . . . 0.0 111.884 -168.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -66.42 122.6 17.89 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 166.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -91.03 129.41 41.85 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 176.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 18.1 p -132.8 173.25 11.57 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 126.339 1.855 . . . . 0.0 106.6 167.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.8 tptp -53.13 -44.12 67.46 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 119.739 1.154 . . . . 0.0 112.641 -169.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -59.33 -61.75 2.4 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.373 0.533 . . . . 0.0 110.156 173.231 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -64.74 -18.87 65.43 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.916 0.886 . . . . 0.0 112.35 -171.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 47.5 ttp180 -51.76 -38.91 57.41 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 124.644 1.178 . . . . 0.0 111.33 168.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 89.4 mttt -64.77 -52.45 56.87 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 119.975 1.261 . . . . 0.0 111.247 169.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.2 m -59.42 -57.64 12.11 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 125.116 1.366 . . . . 0.0 111.355 -166.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.8 t -95.18 161.02 14.28 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.044 0.538 . . . . 0.0 110.478 -169.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -140.42 -53.78 0.51 Allowed 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 125.761 1.624 . . . . 0.0 109.536 -169.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -58.88 -57.62 12.26 Favored 'General case' 0 C--O 1.233 0.194 0 C-N-CA 123.434 0.694 . . . . 0.0 110.822 173.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 57.4 m -61.95 -36.41 81.33 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.914 0.886 . . . . 0.0 111.58 177.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 47.2 ttp180 -52.16 -54.56 29.22 Favored 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 124.07 0.948 . . . . 0.0 110.06 172.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.27 -45.28 92.23 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.888 0.875 . . . . 0.0 111.318 178.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 57.6 ttp -60.19 -49.78 76.28 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.801 0.84 . . . . 0.0 110.954 -178.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -56.91 -49.39 75.73 Favored 'General case' 0 CA--C 1.52 -0.186 0 CA-C-O 118.021 -0.99 . . . . 0.0 109.76 176.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.82 -56.59 8.26 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 123.532 0.733 . . . . 0.0 111.052 177.601 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.2 mt -47.8 -58.9 3.77 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 124.377 1.071 . . . . 0.0 112.54 171.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -56.06 -52.56 63.81 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 123.637 0.775 . . . . 0.0 110.957 -174.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 32.5 m -66.56 -40.56 86.65 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 CA-C-N 118.548 0.613 . . . . 0.0 110.895 -170.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 152.2 17.09 0.06 OUTLIER Glycine 0 C--N 1.342 0.862 0 CA-C-O 118.527 -1.152 . . . . 0.0 114.953 168.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.5 mtp -79.77 96.53 6.31 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 104.816 -2.29 . . . . 0.0 104.816 167.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -68.23 129.82 41.08 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 179.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.3 tmtt? -52.41 -51.17 60.51 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 123.393 0.677 . . . . 0.0 110.4 169.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -65.02 -11.4 38.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.885 0.874 . . . . 0.0 113.166 177.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -63.22 -43.96 97.77 Favored Glycine 0 CA--C 1.529 0.921 0 C-N-CA 124.128 0.871 . . . . 0.0 111.335 169.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 39.1 t -69.67 137.73 23.56 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.504 -1.295 . . . . 0.0 107.504 168.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 18.2 mtm180 -129.24 141.57 51.09 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 123.976 0.91 . . . . 0.0 109.795 -169.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -65.64 -34.23 77.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.55 1.14 . . . . 0.0 109.41 166.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 19.7 t0 -65.25 -14.71 61.33 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.804 1.642 . . . . 0.0 112.217 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 76.6 mtm180 51.52 60.39 3.89 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 125.751 1.62 . . . . 0.0 111.69 165.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 20.3 t -93.77 87.68 2.26 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 -167.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 12.2 mtt180 -58.12 140.62 52.42 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 174.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.6 14.45 54.77 Favored Glycine 0 CA--C 1.53 1.003 0 CA-C-O 118.789 -1.006 . . . . 0.0 114.594 -176.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.07 74.3 2.5 Favored Glycine 0 C--N 1.338 0.676 0 CA-C-N 119.656 1.728 . . . . 0.0 109.703 178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 47.9 mtt180 -61.08 154.1 23.8 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.067 1.347 . . . . 0.0 111.419 -169.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -133.85 149.23 51.35 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 124.994 1.318 . . . . 0.0 109.483 -174.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -143.08 104.14 4.25 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 105.238 -2.134 . . . . 0.0 105.238 167.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 62.5 m-85 -65.18 140.51 58.77 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 123.021 0.528 . . . . 0.0 109.749 -179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt . . . . . 0 C--O 1.236 0.384 0 C-N-CA 125.101 1.36 . . . . 0.0 108.974 173.238 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.972 1 O4'-C1'-N19 114.872 8.841 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.176 0 O4'-C1'-N19 110.546 3.432 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.36 1 O4'-C1'-N19 112.186 5.482 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.451 1 O4'-C1'-N19 113.061 6.576 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.076 0 O4'-C1'-N19 110.79 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.592 0 O5'-C5'-C4' 115.773 3.981 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.098 1 O4'-C1'-N19 112.481 5.851 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.228 0 P-O3'-C3' 124.289 3.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.486 0 O4'-C4'-C3' 108.681 3.081 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 1 O4'-C1'-N19 113.499 7.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.406 0 O4'-C1'-N19 110.226 3.033 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.634 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.188 0 O4'-C1'-N19 110.667 3.584 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.098 0 O4'-C1'-N19 110.113 2.892 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.05 1 O4'-C1'-N19 111.221 4.276 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.827 0 P-O3'-C3' 122.97 2.725 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 113.199 6.749 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 111.279 4.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.711 1 O4'-C1'-N19 111.368 4.46 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.586 0 O4'-C4'-C3' 108.536 2.936 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.624 0 O4'-C4'-C3' 108.675 3.075 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 112.584 5.98 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.613 0 O4'-C1'-N19 110.003 2.754 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.383 1 O4'-C1'-N19 111.009 4.011 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.064 0 O4'-C1'-N19 110.34 3.175 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.373 0 CA-C-O 120.708 0.29 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 44.9 pt -133.2 159.04 74.19 Favored Pre-proline 0 CA--C 1.539 0.546 0 C-N-CA 125.702 1.601 . . . . 0.0 109.138 175.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.2 140.48 44.91 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.329 2.02 . . . . 0.0 109.725 168.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -59.61 -59.49 5.36 Favored 'General case' 0 N--CA 1.465 0.303 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 168.752 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 72.7 mtt85 -135.87 155.5 50.22 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 126.48 1.912 . . . . 0.0 106.074 168.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -126.1 116.4 21.32 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 -168.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.9 t -59.11 129.28 41.36 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 124.953 1.301 . . . . 0.0 109.95 -171.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.89 -50.23 73.16 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 124.743 1.217 . . . . 0.0 109.738 175.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . 0.265 10.5 p -80.96 -71.61 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.878 -169.086 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 28.1 p -76.01 -38.94 56.77 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.029 1.286 . . . . 0.0 111.728 -169.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 85.45 77.73 1.19 Allowed Glycine 0 CA--C 1.524 0.614 0 N-CA-C 108.201 -1.959 . . . . 0.0 108.201 -168.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -149.58 170.92 17.52 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 127.05 2.14 . . . . 0.0 107.291 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.7 mt -66.14 108.25 0.94 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 N-CA-C 107.569 -1.271 . . . . 0.0 107.569 170.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.1 144.31 50.33 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 123.827 0.851 . . . . 0.0 109.524 169.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.45 -51.98 56.29 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 124.535 1.134 . . . . 0.0 109.925 167.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -164.74 -164.92 21.12 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 124.927 1.251 . . . . 0.0 110.396 -166.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -74.54 136.42 42.14 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.612 -0.885 . . . . 0.0 108.612 167.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . 0.516 ' CE1' ' HE2' ' A' ' 124' ' ' LYS . 37.5 m-70 -143.16 137.73 29.25 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.912 1.285 . . . . 0.0 109.309 165.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 40.55 52.96 3.06 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 127.916 2.486 . . . . 0.0 111.651 -168.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 73.12 8.85 75.37 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.419 1.485 . . . . 0.0 115.953 167.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 14.9 m -136.73 167.01 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-N 119.457 1.628 . . . . 0.0 108.264 169.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -61.08 122.01 13.91 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.679 1.127 . . . . 0.0 108.785 169.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 75.2 m -155.59 154.39 31.6 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 119.277 0.944 . . . . 0.0 111.124 171.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.6 m -68.86 165.33 20.05 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.138 1.375 . . . . 0.0 111.978 -175.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 68.5 mm-40 -61.12 -42.44 98.54 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.73 0.812 . . . . 0.0 110.155 167.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.56 -49.97 75.71 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 123.567 0.747 . . . . 0.0 110.523 178.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 63.9 m -55.37 -51.02 68.17 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.71 1.604 . . . . 0.0 111.157 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.516 ' HE2' ' CE1' ' A' ' 114' ' ' HIS . 5.2 tmmt? -51.44 -58.16 7.02 Favored 'General case' 0 N--CA 1.457 -0.079 0 C-N-CA 123.993 0.917 . . . . 0.0 110.871 171.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -55.84 -50.67 69.92 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.784 0.834 . . . . 0.0 110.601 -174.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -54.34 -55.09 31.95 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.779 0.832 . . . . 0.0 111.404 175.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -57.56 -50.67 72.32 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 124.024 0.93 . . . . 0.0 110.35 -176.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.71 -47.69 77.39 Favored 'General case' 0 C--N 1.338 0.074 0 CA-C-O 118.37 -0.824 . . . . 0.0 111.006 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -47.27 -52.13 17.0 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 119.215 0.916 . . . . 0.0 111.398 171.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 37.9 m -52.38 -52.3 54.36 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.062 0.545 . . . . 0.0 110.32 -178.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.9 mt -74.94 -55.03 12.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 -169.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.92 -42.33 84.58 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.224 1.01 . . . . 0.0 110.138 -178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.9 0.07 89.1 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 125.277 1.417 . . . . 0.0 113.647 -177.138 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 4.3 p30 34.92 51.99 0.56 Allowed 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 127.261 2.225 . . . . 0.0 112.145 -168.013 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 8.5 mt -76.72 147.42 7.6 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 C-N-CA 125.385 1.474 . . . . 0.0 107.215 176.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -130.45 156.34 44.92 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 125.032 1.333 . . . . 0.0 108.664 172.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -138.4 171.1 14.88 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.378 1.471 . . . . 0.0 110.399 -168.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.5 m -142.89 141.43 31.53 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 126.631 1.972 . . . . 0.0 107.65 169.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 41.3 t -67.08 145.53 98.83 Favored Pre-proline 0 CA--C 1.544 0.723 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_exo -59.33 -41.94 54.01 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 123.379 2.719 . . . . 0.0 110.952 165.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -85.98 -119.98 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.822 1.249 . . . . 0.0 108.429 168.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.8 t -151.42 42.46 0.74 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.058 0.943 . . . . 0.0 109.768 -169.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 43.84 74.71 0.11 Allowed 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 126.654 1.982 . . . . 0.0 111.603 -168.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -123.01 -3.75 8.57 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 125.214 1.406 . . . . 0.0 111.335 168.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 37.7 m -70.27 127.48 32.91 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 126.896 2.078 . . . . 0.0 109.939 -169.185 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -70.21 108.68 4.26 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 168.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 9.1 mm -64.34 130.39 29.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 121.754 0.788 . . . . 0.0 109.597 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 14.6 p -138.07 173.43 11.64 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 127.813 2.445 . . . . 0.0 105.59 166.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -58.76 -18.73 34.29 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 120.813 -1.18 . . . . 0.0 113.798 169.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -60.84 -66.22 0.57 Allowed 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 166.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 20.4 mmm180 -67.07 -19.78 65.72 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 118.258 -0.877 . . . . 0.0 111.857 -171.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 22.8 ttm180 -41.02 -49.89 3.34 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 124.63 1.172 . . . . 0.0 110.974 168.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -70.04 -55.4 9.62 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.056 0.542 . . . . 0.0 111.423 173.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.6 m -58.13 -51.08 71.22 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.099 1.36 . . . . 0.0 111.595 -166.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.4 ' HB3' ' SG ' ' A' ' 158' ' ' CYS . 75.4 m -119.85 86.99 2.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.242 1.417 . . . . 0.0 108.614 -171.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 86.7 mt-30 -53.17 -48.53 67.94 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 124.628 1.171 . . . . 0.0 109.369 168.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -51.85 -62.17 1.8 Allowed 'General case' 0 C--N 1.341 0.222 0 C-N-CA 125.126 1.37 . . . . 0.0 110.879 177.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 155' ' ' CYS . 63.7 m -52.62 -46.86 67.21 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 124.378 1.071 . . . . 0.0 111.077 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.5 -46.28 86.82 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-N 119.024 0.829 . . . . 0.0 110.414 -176.356 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -61.38 -47.08 87.49 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.381 0.537 . . . . 0.0 110.724 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 65.5 mtt -53.89 -51.68 62.93 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.055 0.942 . . . . 0.0 110.643 172.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -59.28 -47.17 86.38 Favored 'General case' 0 C--O 1.225 -0.201 0 C-N-CA 124.307 1.043 . . . . 0.0 109.675 -176.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.33 -57.35 8.1 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.409 1.084 . . . . 0.0 110.618 177.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -53.41 -51.12 63.61 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.085 0.954 . . . . 0.0 111.738 175.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -54.91 -55.51 29.76 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.138 0.975 . . . . 0.0 111.002 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.7 m -68.37 -45.5 82.26 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 118.84 0.746 . . . . 0.0 111.109 -169.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 149.85 52.51 0.02 OUTLIER Glycine 0 C--N 1.339 0.717 0 CA-C-N 118.733 0.697 . . . . 0.0 111.873 169.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -116.89 89.08 3.03 Favored 'General case' 0 C--O 1.233 0.227 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 166.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 34.2 mt -66.53 139.67 57.94 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 -177.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -38.32 -55.52 1.34 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 126.024 1.729 . . . . 0.0 110.663 169.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -63.29 -11.34 21.18 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.141 1.377 . . . . 0.0 113.733 -170.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.39 -48.04 72.11 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.642 -0.983 . . . . 0.0 110.642 167.369 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 60.7 t -75.06 127.66 36.75 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 105.863 -1.903 . . . . 0.0 105.863 167.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 6.5 ptp180 -126.21 136.64 53.06 Favored 'General case' 0 N--CA 1.463 0.197 0 O-C-N 121.819 -0.55 . . . . 0.0 109.761 -174.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.57 -16.02 63.85 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.02 0.928 . . . . 0.0 111.125 177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -56.98 -23.4 45.62 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.261 1.024 . . . . 0.0 112.18 168.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 35.1 ttm-85 49.86 60.43 3.81 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 126.574 1.949 . . . . 0.0 111.346 165.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 1.3 p -126.7 115.41 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 15.1 mtt-85 -57.65 143.3 41.92 Favored 'General case' 0 C--O 1.233 0.196 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 -175.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 52.3 29.96 31.34 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-O 118.501 -1.166 . . . . 0.0 114.681 -174.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -78.13 59.97 3.91 Favored Glycine 0 C--N 1.34 0.772 0 N-CA-C 108.965 -1.654 . . . . 0.0 108.965 168.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 16.0 ptt180 -55.1 131.33 44.82 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 126.096 1.758 . . . . 0.0 113.491 -165.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -71.87 126.34 29.48 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 167.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 67.0 mmtt -139.52 109.12 6.22 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 105.171 -2.159 . . . . 0.0 105.171 167.073 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 -61.81 134.68 57.02 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 169.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 66.9 mttm . . . . . 0 C--O 1.239 0.506 0 C-N-CA 125.931 1.693 . . . . 0.0 107.038 173.811 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.297 0 O4'-C1'-N19 110.835 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.993 0 O4'-C1'-N19 110.629 3.536 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.84 0 O4'-C4'-C3' 108.653 3.053 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.882 1 O4'-C1'-N19 112.816 6.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.872 1 O4'-C1'-N19 114.595 8.494 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 1 O4'-C1'-N19 111.178 4.222 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.584 1 O4'-C1'-N19 111.538 4.673 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.622 0 O4'-C1'-N19 110.771 3.714 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.546 0 O4'-C1'-N19 110.264 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.862 1 O4'-C1'-N19 111.647 4.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.29 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.57 1 O4'-C1'-N19 112.116 5.394 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.333 1 O4'-C1'-N19 112.51 5.887 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.241 1 O4'-C1'-N19 111.075 4.093 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.78 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.171 1 O4'-C1'-N19 112.496 5.87 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.98 1 O4'-C1'-N19 111.144 4.18 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.147 1 O4'-C1'-N19 112.447 5.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.871 1 O4'-C1'-N19 112.61 6.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.659 0 O4'-C1'-N19 109.661 2.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.941 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.718 0 O4'-C1'-N19 110.773 3.716 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.336 1 O4'-C1'-N19 112.637 6.046 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.335 0 O4'-C1'-N19 110.372 3.215 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.502 0 O4'-C1'-N19 110.14 2.925 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 0 P-O3'-C3' 123.427 3.106 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.239 0.516 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 21.0 tt -59.13 139.8 87.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 168.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -71.59 110.18 2.81 Favored 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.062 1.841 . . . . 0.0 109.899 169.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp -139.28 167.04 22.98 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.383 1.873 . . . . 0.0 107.776 168.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 26.8 tpt180 -72.6 91.1 1.4 Allowed 'General case' 0 CA--C 1.529 0.158 0 N-CA-C 107.105 -1.442 . . . . 0.0 107.105 168.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.69 132.91 43.71 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 123.875 0.87 . . . . 0.0 109.506 -172.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 51.6 t -56.08 131.22 46.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 C-N-CA 126.816 2.047 . . . . 0.0 108.428 167.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -61.01 -50.21 74.29 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.368 0.667 . . . . 0.0 110.636 174.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.9 m -72.77 -69.93 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.567 -169.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 24.6 p -90.66 -0.42 57.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 120.148 1.34 . . . . 0.0 113.936 -168.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.2 54.12 25.75 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.968 -0.853 . . . . 0.0 110.968 168.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -145.61 165.1 29.66 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 127.366 2.266 . . . . 0.0 107.21 -174.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.2 mt -67.11 115.48 5.1 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-N 120.242 1.383 . . . . 0.0 107.934 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.04 145.65 49.81 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 124.543 1.137 . . . . 0.0 109.97 173.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -64.49 -44.42 91.02 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.502 1.121 . . . . 0.0 111.155 168.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 179.84 -169.54 40.44 Favored Glycine 0 CA--C 1.525 0.713 0 O-C-N 121.971 -0.456 . . . . 0.0 112.117 -169.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -62.76 123.52 18.65 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 59.8 m80 -139.9 132.88 29.4 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 125.229 1.412 . . . . 0.0 108.216 167.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 40.15 51.95 2.72 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 126.986 2.114 . . . . 0.0 110.971 -167.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 71.93 6.56 64.17 Favored Glycine 0 CA--C 1.533 1.217 0 C-N-CA 125.313 1.435 . . . . 0.0 116.084 167.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 8.6 m -136.29 172.37 15.48 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 119.876 1.838 . . . . 0.0 109.634 169.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -64.25 117.96 7.94 Favored 'General case' 0 C--O 1.235 0.332 0 O-C-N 121.419 -0.801 . . . . 0.0 109.063 169.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 70.8 m -153.31 154.33 34.36 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 123.91 0.884 . . . . 0.0 109.618 168.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 4.4 m -66.84 163.81 18.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.41 1.084 . . . . 0.0 111.097 178.257 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -71.1 -20.84 62.29 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.987 168.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.38 -54.2 49.51 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.741 1.217 . . . . 0.0 110.8 169.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 18.8 m -60.14 -31.67 70.3 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.298 1.839 . . . . 0.0 111.476 -170.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -45.31 -53.76 8.04 Favored 'General case' 0 C--N 1.339 0.148 0 C-N-CA 124.725 1.21 . . . . 0.0 110.708 169.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.71 -50.54 73.52 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 123.926 0.89 . . . . 0.0 110.98 -169.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 30.1 t80 -46.74 -60.14 2.59 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.316 0.646 . . . . 0.0 111.883 169.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -63.67 -46.38 85.85 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.704 0.802 . . . . 0.0 109.979 -167.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -49.85 -63.75 1.02 Allowed 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.85 1.66 . . . . 0.0 111.496 169.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 30.9 mtm105 -56.16 -45.44 79.66 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.708 0.686 . . . . 0.0 109.982 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 92.8 m -53.09 -60.07 3.76 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.883 0.873 . . . . 0.0 110.799 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 73.9 mt -74.28 -52.28 20.63 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 -168.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -63.82 -35.37 80.41 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 118.851 0.75 . . . . 0.0 110.315 -176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.67 -4.51 87.88 Favored Glycine 0 CA--C 1.533 1.185 0 C-N-CA 124.648 1.118 . . . . 0.0 114.055 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.13 47.46 2.04 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 127.201 2.2 . . . . 0.0 112.283 -168.18 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 30.7 mm -68.9 146.95 12.45 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 C-N-CA 125.361 1.464 . . . . 0.0 108.344 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -128.22 155.58 44.32 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 125.431 1.493 . . . . 0.0 107.344 168.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 65.8 m-85 -139.22 168.06 20.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.708 1.203 . . . . 0.0 111.059 -167.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 47.0 m -161.14 115.79 2.07 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 129.246 3.018 . . . . 0.0 104.642 167.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.9 m -65.51 143.31 98.63 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 109.504 -0.554 . . . . 0.0 109.504 170.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -69.42 -38.97 7.77 Favored 'Trans proline' 0 CA--C 1.535 0.551 0 C-N-CA 123.372 2.715 . . . . 0.0 112.743 -168.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -107.32 -103.13 0.35 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.83 1.252 . . . . 0.0 109.417 -168.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.5 p -69.32 -40.66 77.49 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.826 1.25 . . . . 0.0 111.191 -169.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 53.82 43.94 30.26 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.359 1.464 . . . . 0.0 109.049 -166.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -141.95 40.47 1.66 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.844 1.658 . . . . 0.0 109.025 172.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 57.8 m -65.86 126.97 30.18 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.249 1.02 . . . . 0.0 109.602 -174.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -73.94 113.42 11.08 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 29.9 mm -73.5 119.36 20.41 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 N-CA-C 107.378 -1.341 . . . . 0.0 107.378 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 3.6 p -143.57 153.1 42.21 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 127.716 2.407 . . . . 0.0 105.284 168.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 36.6 mttp -55.76 -32.6 63.57 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 120.751 1.614 . . . . 0.0 113.291 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 57.6 ttp180 -60.44 -71.09 0.14 Allowed 'General case' 0 CA--C 1.533 0.315 0 O-C-N 121.355 -0.841 . . . . 0.0 109.951 168.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 90.8 mtm180 -65.95 -21.1 66.4 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.669 0.787 . . . . 0.0 112.521 -169.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -41.57 -49.13 4.08 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 126.365 1.866 . . . . 0.0 109.772 167.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -69.24 -41.51 76.88 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 123.298 0.639 . . . . 0.0 110.783 -172.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 9.5 m -61.0 -48.97 79.37 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.696 1.199 . . . . 0.0 111.263 173.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.41 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 49.7 t -57.53 158.03 6.29 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.207 1.803 . . . . 0.0 110.975 175.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -132.42 -60.48 0.89 Allowed 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.413 1.885 . . . . 0.0 108.852 170.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -78.21 -51.22 10.53 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.222 1.009 . . . . 0.0 111.674 -169.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.41 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 8.9 m -61.87 -28.36 69.44 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.648 0.779 . . . . 0.0 111.565 -167.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -44.71 -56.45 4.42 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.201 1.001 . . . . 0.0 110.52 169.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -64.29 -46.79 82.09 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.011 0.925 . . . . 0.0 109.954 -175.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 20.3 mmt -57.6 -50.02 74.49 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.197 0.999 . . . . 0.0 110.182 -179.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 16.6 tppt? -58.96 -52.19 66.83 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.583 1.153 . . . . 0.0 109.125 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -50.76 -54.83 20.22 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.219 1.008 . . . . 0.0 111.117 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 18.7 mt -53.37 -53.97 43.39 Favored 'General case' 0 N--CA 1.462 0.175 0 C-N-CA 124.086 0.954 . . . . 0.0 111.456 174.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -55.76 -54.72 40.96 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 124.09 0.956 . . . . 0.0 110.793 -175.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.9 m -68.29 -39.53 81.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-O 118.934 -0.555 . . . . 0.0 111.541 -169.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -179.67 -56.34 0.08 OUTLIER Glycine 0 C--N 1.341 0.82 0 CA-C-O 118.871 -0.961 . . . . 0.0 113.989 -168.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 40.8 mtm -65.35 100.0 0.45 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.875 0.87 . . . . 0.0 109.624 -167.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 39.2 mt -72.52 142.18 48.5 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.041 -0.725 . . . . 0.0 109.041 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -47.08 -47.91 22.8 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.457 1.103 . . . . 0.0 111.303 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -61.49 -14.95 33.22 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.82 1.045 . . . . 0.0 113.82 -177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.57 -44.52 85.87 Favored Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.044 0.831 . . . . 0.0 111.628 169.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 98.2 t -69.09 120.51 16.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.992 -1.484 . . . . 0.0 106.992 168.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -77.2 113.33 14.84 Favored 'General case' 0 C--N 1.334 -0.102 0 N-CA-C 106.901 -1.518 . . . . 0.0 106.901 170.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.0 mt -61.63 -21.02 64.02 Favored 'General case' 0 N--CA 1.468 0.435 0 O-C-N 121.817 -0.552 . . . . 0.0 111.61 169.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.76 -23.25 59.73 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.777 1.231 . . . . 0.0 112.626 168.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 61.9 ttp85 55.06 60.26 3.55 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 126.851 2.061 . . . . 0.0 110.377 169.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 19.4 m -122.91 137.57 55.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 C-N-CA 125.664 1.585 . . . . 0.0 107.154 173.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.9 mtt180 -67.11 155.16 39.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-O 120.925 0.393 . . . . 0.0 110.535 -171.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.63 43.29 98.14 Favored Glycine 0 CA--C 1.523 0.575 0 N-CA-C 115.539 0.976 . . . . 0.0 115.539 166.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -71.49 168.68 50.85 Favored Glycine 0 CA--C 1.536 1.367 0 N-CA-C 108.316 -1.914 . . . . 0.0 108.316 163.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 29.0 ptt85 -152.53 140.56 20.24 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 121.017 -1.284 . . . . 0.0 110.092 167.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -145.08 141.46 28.85 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 127.058 2.143 . . . . 0.0 106.364 178.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -132.42 132.7 43.06 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 107.335 -1.357 . . . . 0.0 107.335 169.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -72.52 157.22 38.02 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.105 0.562 . . . . 0.0 110.519 -169.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 64.8 tttp . . . . . 0 C--O 1.235 0.326 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.209 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.546 4.359 0 O4'-C1'-N19 110.747 3.683 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.336 0 P-O3'-C3' 123.554 3.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.12 1 O4'-C1'-N19 111.779 4.974 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.948 0 O4'-C4'-C3' 107.938 2.338 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.911 1 O4'-C1'-N19 114.511 8.388 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.05 0 O4'-C1'-N19 110.847 3.809 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.894 0 O4'-C1'-N19 110.75 3.687 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.515 0 P-O3'-C3' 123.538 3.198 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.887 1 O4'-C1'-N19 112.804 6.255 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.99 0 O4'-C1'-N19 110.745 3.682 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.208 1 O4'-C1'-N19 112.913 6.391 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.319 1 O4'-C1'-N19 111.012 4.015 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.421 0 O4'-C1'-N19 110.676 3.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.031 1 O4'-C1'-N19 111.547 4.684 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.32 0 O4'-C1'-N19 110.535 3.419 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.526 2 O4'-C1'-N19 112.442 5.802 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.47 0 O4'-C1'-N19 110.151 2.938 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.57 0 P-O3'-C3' 123.349 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.665 1 O4'-C1'-N19 112.343 5.678 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 113.158 6.698 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.625 0 O4'-C4'-C3' 108.098 2.498 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.71 0 O4'-C4'-C3' 108.796 3.196 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 113.143 6.679 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 0 O4'-C4'-C3' 107.766 2.166 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.217 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.13 1 O4'-C1'-N19 111.387 4.484 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.352 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.0 pt -131.24 156.43 80.15 Favored Pre-proline 0 CA--C 1.539 0.525 0 C-N-CA 125.458 1.503 . . . . 0.0 108.985 169.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -70.98 125.57 11.64 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.386 2.057 . . . . 0.0 108.794 167.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -154.42 170.99 20.07 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 125.468 1.507 . . . . 0.0 109.049 -177.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 22.8 tpp180 -125.77 102.99 7.57 Favored 'General case' 0 CA--C 1.519 -0.242 0 N-CA-C 105.793 -1.929 . . . . 0.0 105.793 168.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 90.4 mt -73.42 140.5 46.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 169.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 43.7 t -60.84 124.84 21.63 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 165.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -81.35 -10.45 59.55 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.65 0.78 . . . . 0.0 112.768 -179.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 22.7 t -69.99 -68.54 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 170.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -95.79 -80.98 0.41 Allowed 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.128 0.971 . . . . 0.0 108.642 -171.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 143.44 62.47 0.02 OUTLIER Glycine 0 CA--C 1.518 0.278 0 N-CA-C 109.803 -1.319 . . . . 0.0 109.803 178.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -137.23 160.7 38.26 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.452 1.901 . . . . 0.0 107.12 169.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 76.9 mt -63.67 118.51 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 119.953 1.251 . . . . 0.0 108.18 -177.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -66.46 135.29 54.04 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 124.23 1.012 . . . . 0.0 108.901 177.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -65.97 -39.3 90.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.108 0.963 . . . . 0.0 112.185 171.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -175.29 -178.56 45.23 Favored Glycine 0 CA--C 1.525 0.702 0 CA-C-N 118.539 0.609 . . . . 0.0 111.604 -169.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -75.38 130.7 39.44 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 169.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.5 m80 -142.27 128.81 20.22 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 126.579 1.952 . . . . 0.0 107.031 -179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . 0.274 63.3 m-85 44.55 50.47 8.26 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.351 1.46 . . . . 0.0 110.217 -163.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.55 13.6 61.07 Favored Glycine 0 CA--C 1.533 1.202 0 C-N-CA 127.295 2.378 . . . . 0.0 115.669 168.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 38.6 t -139.47 151.14 22.55 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 119.567 1.683 . . . . 0.0 107.315 173.29 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -56.9 116.3 3.11 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.5 -0.75 . . . . 0.0 109.982 172.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 45.1 m -153.73 161.97 41.65 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 125.014 1.326 . . . . 0.0 108.886 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 3.4 m -62.03 158.28 16.89 Favored 'General case' 0 CA--C 1.543 0.686 0 O-C-N 121.592 -0.692 . . . . 0.0 111.12 173.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -62.64 -36.43 82.81 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.663 -0.648 . . . . 0.0 110.27 167.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.36 -42.88 74.49 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.404 1.082 . . . . 0.0 111.837 173.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 39.4 m -56.82 -56.09 26.07 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.391 1.076 . . . . 0.0 110.409 178.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.4 pttp -58.98 -39.68 82.5 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 118.593 -0.718 . . . . 0.0 111.927 175.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.01 -39.0 80.55 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.275 0.943 . . . . 0.0 112.428 -179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.21 -65.48 0.67 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.687 0.795 . . . . 0.0 109.672 167.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -53.17 -46.04 68.76 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 126.108 1.763 . . . . 0.0 112.698 -167.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 51.7 pttt -53.24 -42.79 66.77 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 124.457 1.103 . . . . 0.0 111.727 -177.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 47.5 mtm105 -69.38 -43.52 73.38 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 123.928 0.891 . . . . 0.0 109.276 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 7.4 m -48.82 -53.01 21.02 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.109 0.964 . . . . 0.0 110.722 175.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 6.6 mm -70.0 -57.81 7.18 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 -169.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 37.3 mt-30 -64.36 -37.01 86.01 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.802 0.841 . . . . 0.0 110.375 -172.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.69 -8.76 87.18 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.402 1.477 . . . . 0.0 113.901 176.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.57 47.78 3.37 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.068 2.147 . . . . 0.0 111.933 -167.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 15.7 mm -71.87 147.69 10.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 124.552 1.141 . . . . 0.0 108.001 177.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -131.24 158.5 40.42 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 125.472 1.509 . . . . 0.0 108.578 172.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 45.3 m-85 -137.62 173.25 11.86 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.528 1.531 . . . . 0.0 109.929 -169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.1 m -139.16 133.84 31.98 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 126.101 1.76 . . . . 0.0 107.577 176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 18.5 t -63.94 143.61 98.16 Favored Pre-proline 0 CA--C 1.542 0.673 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 169.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -61.23 -43.85 26.78 Favored 'Trans proline' 0 N--CA 1.456 -0.681 0 C-N-CA 123.073 2.516 . . . . 0.0 111.056 166.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -88.03 -136.92 0.1 Allowed 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.43 1.492 . . . . 0.0 108.938 169.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 9.1 m -132.29 84.54 2.16 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . 0.268 0.0 OUTLIER 38.73 42.15 0.58 Allowed 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 128.789 2.836 . . . . 0.0 113.756 -169.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -87.67 -37.26 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.586 0.754 . . . . 0.0 111.294 -168.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 10.1 m -58.6 113.95 2.25 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.161 1.785 . . . . 0.0 111.866 -166.68 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -83.42 98.62 9.6 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 105.283 -2.118 . . . . 0.0 105.283 166.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 40.9 mm -66.49 136.97 25.77 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 -170.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.415 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 71.8 p -124.3 173.84 8.11 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 128.046 2.539 . . . . 0.0 106.431 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -55.66 -32.34 63.13 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 120.605 -1.309 . . . . 0.0 112.967 172.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.3 mtp85 -66.45 -64.02 0.95 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.253 0.621 . . . . 0.0 110.581 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.415 ' HB2' ' H ' ' A' ' 148' ' ' THR . 97.7 mtt180 -66.37 -15.1 63.01 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.082 0.953 . . . . 0.0 112.681 -168.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 52.2 ttt85 -36.38 -58.36 0.7 Allowed 'General case' 0 N--CA 1.46 0.072 0 C-N-CA 126.809 2.044 . . . . 0.0 111.842 169.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 28.8 mmtp -62.96 -34.88 78.45 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 118.807 0.731 . . . . 0.0 112.241 -177.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 10.6 m -60.43 -42.48 96.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.766 1.227 . . . . 0.0 111.399 -169.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 49.4 t -134.65 116.1 14.57 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.788 1.235 . . . . 0.0 109.033 -170.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -68.36 -42.09 79.71 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.582 1.153 . . . . 0.0 110.39 168.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -64.41 -60.83 2.7 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.764 0.826 . . . . 0.0 110.343 -169.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 85.4 m -56.18 -38.81 71.45 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.599 0.759 . . . . 0.0 111.716 179.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -53.59 -57.33 11.13 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.996 0.919 . . . . 0.0 110.429 172.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.22 -50.77 72.4 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.6 1.16 . . . . 0.0 111.498 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -60.36 -42.9 96.72 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.483 1.113 . . . . 0.0 111.428 -177.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -57.85 -57.38 13.01 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 117.449 -1.262 . . . . 0.0 109.143 169.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -47.95 -53.09 17.1 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 124.123 0.969 . . . . 0.0 111.18 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 8.8 mt -41.34 -64.13 0.6 Allowed 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 126.339 1.855 . . . . 0.0 112.352 169.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -66.53 -52.44 45.74 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.341 1.057 . . . . 0.0 110.379 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 19.6 m -68.84 -42.51 82.66 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 C-N-CA 123.23 0.612 . . . . 0.0 111.899 -167.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . -154.0 -78.39 0.02 OUTLIER Glycine 0 C--N 1.342 0.861 0 CA-C-N 118.921 0.782 . . . . 0.0 112.722 -166.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 59.6 mtm -69.74 104.71 2.5 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -169.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -68.08 138.44 55.77 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 169.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.61 -43.7 62.63 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.058 0.543 . . . . 0.0 111.674 169.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.44 -12.23 59.77 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.543 0.737 . . . . 0.0 112.868 -177.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -61.59 -50.71 63.57 Favored Glycine 0 CA--C 1.531 1.051 0 N-CA-C 110.368 -1.093 . . . . 0.0 110.368 167.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.2 t -63.37 136.32 26.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 108.163 -1.051 . . . . 0.0 108.163 170.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -142.68 128.07 18.89 Favored 'General case' 0 C--N 1.333 -0.125 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 35.4 tp -61.88 -21.09 64.4 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.478 1.111 . . . . 0.0 111.514 173.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -51.45 -32.59 27.46 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 127.219 2.207 . . . . 0.0 111.943 167.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 49.86 58.64 5.23 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 126.449 1.9 . . . . 0.0 111.349 168.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 6.8 m -94.85 70.79 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 174.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -66.24 157.53 31.26 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 114.979 -1.009 . . . . 0.0 110.804 -167.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 60.44 17.67 48.18 Favored Glycine 0 CA--C 1.533 1.164 0 CA-C-O 119.007 -0.885 . . . . 0.0 113.587 -167.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.78 87.09 1.55 Allowed Glycine 0 C--N 1.336 0.578 0 N-CA-C 108.207 -1.957 . . . . 0.0 108.207 174.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.35 122.85 15.58 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 123.627 0.771 . . . . 0.0 109.705 -168.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.86 158.57 33.16 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 124.901 1.28 . . . . 0.0 111.766 -168.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.6 mptt -128.54 165.51 20.61 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.697 1.999 . . . . 0.0 107.406 166.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -128.65 169.75 14.07 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 124.848 1.259 . . . . 0.0 109.733 169.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.397 0 C-N-CA 126.308 1.843 . . . . 0.0 108.993 -169.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.811 1 O4'-C1'-N19 114.357 8.197 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.986 5.232 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.726 0 O4'-C1'-N19 110.22 3.025 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.395 0 O4'-C4'-C3' 108.897 3.297 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.328 1 O4'-C1'-N19 112.046 5.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.842 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.899 1 O4'-C1'-N19 112.304 5.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.771 0 P-O3'-C3' 123.703 3.335 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -2.618 0 P-O3'-C3' 122.688 2.49 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 113.243 6.804 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.234 0 O4'-C1'-N19 110.085 2.857 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.744 0 O4'-C1'-N19 110.505 3.381 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.332 0 O4'-C1'-N19 110.622 3.527 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.958 1 O4'-C1'-N19 111.454 4.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.54 3.616 0 O4'-C1'-N19 110.441 3.301 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.344 2 O4'-C1'-N19 112.568 5.96 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.136 0 O4'-C4'-C3' 107.677 2.077 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 1 O4'-C1'-N19 113.102 6.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.372 1 O4'-C1'-N19 113.799 7.498 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.017 1 O4'-C1'-N19 111.247 4.309 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.374 0 O4'-C1'-N19 110.281 3.102 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.743 0 P-O3'-C3' 123.528 3.19 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.8 1 O4'-C1'-N19 113.924 7.655 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.462 2 O4'-C1'-N19 112.627 6.033 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.913 0 O4'-C1'-N19 110.792 3.741 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.781 0 O4'-C1'-N19 110.906 3.883 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.428 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 43.9 pt -68.03 165.1 35.51 Favored Pre-proline 0 CA--C 1.543 0.683 0 C-N-CA 123.382 0.673 . . . . 0.0 110.307 168.609 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -65.37 85.79 0.2 Allowed 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 122.615 2.21 . . . . 0.0 110.875 165.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 59.0 tptt -148.96 140.19 23.15 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 126.309 1.843 . . . . 0.0 106.784 169.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 93.8 mtm-85 -66.35 110.59 3.13 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.72 140.17 44.18 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.836 0.854 . . . . 0.0 108.698 177.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.2 t -68.68 118.92 12.29 Favored 'General case' 0 N--CA 1.445 -0.721 0 C-N-CA 125.685 1.594 . . . . 0.0 108.252 -169.886 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -66.08 -19.58 65.89 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.639 0.775 . . . . 0.0 112.848 -172.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.8 m -84.7 -73.68 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 CA-C-N 118.852 0.751 . . . . 0.0 111.301 172.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 14.8 p -75.97 -26.16 56.52 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.909 1.078 . . . . 0.0 113.909 -167.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.53 68.63 1.58 Allowed Glycine 0 CA--C 1.527 0.786 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -169.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -138.78 160.33 39.96 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 127.18 2.192 . . . . 0.0 106.958 171.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 96.0 mt -62.54 117.46 3.61 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 173.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.15 142.07 43.61 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.2 p -59.07 -50.36 74.36 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 123.477 0.711 . . . . 0.0 109.504 167.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -167.05 -177.72 38.95 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.233 0.92 . . . . 0.0 111.4 -168.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -71.48 126.52 29.86 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 166.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 34.2 m-70 -135.0 135.43 41.37 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 124.613 1.165 . . . . 0.0 110.561 169.016 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 46.31 49.12 13.15 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.62 1.568 . . . . 0.0 110.25 -167.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 74.04 8.35 78.33 Favored Glycine 0 CA--C 1.533 1.201 0 N-CA-C 116.422 1.329 . . . . 0.0 116.422 167.53 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.7 m -140.06 158.94 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 119.741 1.771 . . . . 0.0 108.838 169.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.35 120.39 9.21 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 121.39 -0.819 . . . . 0.0 109.592 172.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 48.3 m -151.76 148.39 27.82 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 123.741 0.817 . . . . 0.0 110.857 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 12.1 m -60.9 161.78 7.76 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.338 1.055 . . . . 0.0 111.942 173.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.2 mm-40 -62.14 -40.15 94.98 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.494 0.717 . . . . 0.0 110.135 167.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.02 -50.39 74.25 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.967 0.907 . . . . 0.0 111.099 176.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 81.6 m -61.78 -41.75 98.12 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.493 1.517 . . . . 0.0 111.496 177.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.1 ttmt -50.4 -59.66 3.78 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.808 0.731 . . . . 0.0 109.159 167.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.8 -49.04 76.57 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.333 1.053 . . . . 0.0 111.535 -173.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -49.7 -63.65 1.05 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.957 1.303 . . . . 0.0 111.023 171.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -62.48 -44.75 95.62 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.962 0.905 . . . . 0.0 110.42 -169.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -46.36 -67.28 0.3 Allowed 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 126.453 1.901 . . . . 0.0 109.983 168.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 75.3 mtp85 -57.43 -41.89 81.3 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 118.728 -0.653 . . . . 0.0 110.957 -172.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 29.7 m -51.24 -55.74 16.56 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.744 0.817 . . . . 0.0 110.2 176.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 67.4 mt -77.53 -50.23 20.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -55.64 -41.4 73.52 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.742 0.817 . . . . 0.0 110.45 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -85.81 -3.3 85.93 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.039 1.304 . . . . 0.0 113.795 -177.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.24 47.21 2.07 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 126.992 2.117 . . . . 0.0 112.422 -167.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.3 mm -70.42 149.2 10.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 125.088 1.355 . . . . 0.0 108.154 173.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -131.53 156.06 46.36 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 125.301 1.441 . . . . 0.0 108.108 169.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.16 158.57 43.84 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.077 1.351 . . . . 0.0 110.255 -168.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 58.3 m -157.26 116.48 3.34 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 127.91 2.484 . . . . 0.0 105.686 168.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.1 p -69.91 157.87 88.64 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.116 0.566 . . . . 0.0 110.426 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -75.59 -17.33 18.38 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 123.239 2.626 . . . . 0.0 112.57 175.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -86.73 -141.57 0.1 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 125.207 1.403 . . . . 0.0 110.267 -169.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 26.8 p -72.61 -16.92 61.72 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.395 1.478 . . . . 0.0 112.925 -168.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 12.9 m120 58.56 31.25 20.85 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 126.207 1.803 . . . . 0.0 111.143 -167.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -150.85 39.58 0.71 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.144 1.378 . . . . 0.0 109.503 168.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 44.0 m -65.19 125.83 26.23 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.036 1.335 . . . . 0.0 109.534 -172.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -75.15 117.93 17.53 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.494 -1.299 . . . . 0.0 107.494 168.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 42.8 mm -80.61 145.45 9.01 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -173.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.428 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 80.4 p -132.02 171.95 12.97 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 125.944 1.698 . . . . 0.0 107.747 170.823 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -51.17 -33.5 27.45 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.757 0.823 . . . . 0.0 113.158 169.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -73.53 -62.12 1.6 Allowed 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 123.31 0.644 . . . . 0.0 110.523 170.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.428 ' HB2' ' H ' ' A' ' 148' ' ' THR . 99.2 mtt180 -62.6 -24.11 67.4 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.915 0.886 . . . . 0.0 112.86 -166.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 20.8 ptt180 -49.11 -38.73 25.8 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 119.158 0.89 . . . . 0.0 112.103 175.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -65.14 -48.9 71.92 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.797 0.839 . . . . 0.0 110.027 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 15.2 m -70.32 -64.64 0.85 Allowed 'General case' 0 C--O 1.236 0.363 0 C-N-CA 125.029 1.332 . . . . 0.0 109.899 -174.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 17.6 t -86.51 101.53 13.27 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -75.83 -39.51 56.57 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.734 1.214 . . . . 0.0 110.336 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -66.84 -63.03 1.15 Allowed 'General case' 0 C--O 1.235 0.308 0 C-N-CA 123.892 0.877 . . . . 0.0 111.171 -169.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 70.8 m -63.74 -27.47 69.22 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 119.287 -0.387 . . . . 0.0 112.03 -178.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.6 ttt180 -57.99 -54.27 48.83 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 119.056 0.844 . . . . 0.0 110.641 169.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -59.8 -44.06 94.16 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.974 0.806 . . . . 0.0 111.54 177.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 56.7 ttp -56.19 -51.08 69.34 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.96 0.904 . . . . 0.0 111.049 176.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -55.53 -52.39 63.87 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-O 118.108 -0.949 . . . . 0.0 108.938 175.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -48.31 -56.57 7.73 Favored 'General case' 0 C--O 1.235 0.324 0 C-N-CA 125.381 1.472 . . . . 0.0 110.925 -173.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.1 mt -51.92 -52.54 49.36 Favored 'General case' 0 C--O 1.234 0.238 0 C-N-CA 124.473 1.109 . . . . 0.0 112.123 174.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -57.25 -55.45 34.54 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.672 0.789 . . . . 0.0 110.778 -178.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.82 -37.97 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 CA-C-O 118.761 -0.638 . . . . 0.0 111.211 -169.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 151.98 4.25 0.17 Allowed Glycine 0 CA--C 1.528 0.895 0 CA-C-O 118.543 -1.143 . . . . 0.0 115.648 168.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 90.7 mtp -74.74 95.7 2.93 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 106.162 -1.792 . . . . 0.0 106.162 168.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 24.7 mt -73.03 149.48 43.19 Favored 'General case' 0 C--O 1.233 0.233 0 N-CA-C 109.272 -0.64 . . . . 0.0 109.272 -178.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -54.54 -36.23 64.06 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.612 0.365 . . . . 0.0 110.169 166.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -51.49 -27.63 11.09 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.302 1.841 . . . . 0.0 113.081 172.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -64.04 -52.58 43.49 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 125.184 1.373 . . . . 0.0 111.739 -169.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 61.6 t -71.42 145.2 12.66 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 124.341 1.057 . . . . 0.0 108.598 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 23.5 mtm180 -132.02 130.48 41.43 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 123.536 0.734 . . . . 0.0 111.092 -177.358 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -66.61 -31.91 72.91 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.383 1.073 . . . . 0.0 108.742 165.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -63.16 -14.87 53.93 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 126.6 1.96 . . . . 0.0 112.956 -176.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 59.6 60.46 2.25 Favored 'General case' 0 C--O 1.234 0.249 0 C-N-CA 125.431 1.492 . . . . 0.0 112.314 165.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 14.7 t -106.76 73.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 105.953 -1.869 . . . . 0.0 105.953 -170.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 73.1 mtm-85 -57.72 142.06 46.52 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.928 175.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 63.33 13.86 51.47 Favored Glycine 0 CA--C 1.531 1.086 0 C-N-CA 124.229 0.919 . . . . 0.0 114.399 -172.62 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -84.4 84.05 1.6 Allowed Glycine 0 C--N 1.339 0.716 0 N-CA-C 109.069 -1.612 . . . . 0.0 109.069 177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 55.8 mtt180 -63.39 145.77 54.91 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 123.793 0.837 . . . . 0.0 110.179 -170.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -147.66 147.32 29.87 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.964 1.306 . . . . 0.0 109.505 -169.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -140.79 178.66 7.19 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 127.125 2.17 . . . . 0.0 107.931 169.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -133.03 154.06 50.89 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 124.634 1.173 . . . . 0.0 108.868 169.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 60.9 mtpt . . . . . 0 C--O 1.236 0.368 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 167.376 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.053 1 O4'-C1'-N19 111.357 4.446 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 O4'-C1'-N19 110.412 3.265 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.596 0 P-O3'-C3' 123.482 3.152 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.767 1 O4'-C1'-N19 112.267 5.584 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.09 1 O4'-C1'-N19 113.437 7.047 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.191 0 O4'-C1'-N19 110.984 3.98 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.201 1 O4'-C1'-N19 115.068 9.085 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.008 0 O5'-C5'-C4' 114.394 2.996 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.424 0 O4'-C4'-C3' 108.693 3.093 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.498 1 O4'-C1'-N19 113.488 7.11 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.396 0 O4'-C1'-N19 110.205 3.006 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.795 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.225 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.176 1 O4'-C1'-N19 111.37 4.463 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.109 1 O4'-C1'-N19 111.641 4.801 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.278 1 O4'-C1'-N19 112.974 6.468 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.648 0 O4'-C1'-N19 110.125 2.907 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.836 1 O4'-C1'-N19 112.458 5.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.059 1 O4'-C1'-N19 112.935 6.419 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.546 0 O4'-C4'-C3' 108.757 3.157 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.204 0 O4'-C1'-N19 110.863 3.829 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.83 0 P-O3'-C3' 123.479 3.149 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.378 1 O4'-C1'-N19 113.456 7.07 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.689 0 O4'-C1'-N19 110.54 3.425 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.779 0 O4'-C1'-N19 110.706 3.632 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.214 1 O4'-C1'-N19 111.423 4.528 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.424 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 48.8 pt -63.34 154.28 79.19 Favored Pre-proline 0 CA--C 1.542 0.668 0 C-N-CA 122.799 0.44 . . . . 0.0 110.237 168.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -70.08 146.0 56.93 Favored 'Trans proline' 0 N--CA 1.457 -0.643 0 C-N-CA 122.345 2.03 . . . . 0.0 110.047 168.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 40.1 ttpt -69.58 102.0 1.75 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 107.596 -1.261 . . . . 0.0 107.596 168.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 13.7 ptt180 -63.12 127.24 30.33 Favored 'General case' 0 C--O 1.232 0.155 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 168.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 10.4 tp -137.86 122.21 18.25 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.0 -1.482 . . . . 0.0 107.0 -169.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 38.6 t -52.21 126.38 18.66 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 125.699 1.599 . . . . 0.0 109.316 178.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 10.5 mp -64.4 -47.31 79.68 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 122.984 0.514 . . . . 0.0 110.125 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 15.0 p -70.48 -58.28 5.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-O 118.749 -0.643 . . . . 0.0 110.701 -169.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 29.4 p -81.19 -62.37 1.68 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 119.417 1.008 . . . . 0.0 110.216 -175.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 112.6 61.32 0.44 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 126.192 1.853 . . . . 0.0 109.757 -175.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 36.1 t0 -145.34 160.89 40.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 126.375 1.87 . . . . 0.0 108.467 177.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.3 mt -64.73 120.22 11.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 N-CA-C 108.22 -1.029 . . . . 0.0 108.22 -170.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.11 151.13 45.81 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 124.439 1.096 . . . . 0.0 110.325 -175.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 18.8 p -72.65 -40.17 66.58 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 122.515 0.326 . . . . 0.0 110.474 168.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.42 -175.95 41.55 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -169.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -87.06 54.57 3.22 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 122.247 1.023 . . . . 0.0 110.019 -169.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 44.1 m-70 -73.08 138.33 45.8 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.065 0.946 . . . . 0.0 112.474 -171.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 80.2 m-85 46.71 45.21 14.5 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.534 1.533 . . . . 0.0 111.467 -169.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 65.14 17.99 64.3 Favored Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.096 1.332 . . . . 0.0 114.09 169.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 28.2 m -142.85 172.77 7.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 127.381 2.272 . . . . 0.0 106.987 169.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -66.74 126.94 30.59 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 119.952 -1.718 . . . . 0.0 109.709 169.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.9 m -146.11 151.47 37.74 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.817 0.847 . . . . 0.0 111.285 168.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.1 m -67.88 164.86 18.82 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.668 0.787 . . . . 0.0 111.129 168.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -59.79 -52.82 63.84 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.199 0.999 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -67.24 -41.45 85.64 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 118.434 0.561 . . . . 0.0 110.644 -171.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 57.6 m -52.6 -52.63 54.42 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.014 1.726 . . . . 0.0 111.143 170.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 7.9 tttm -50.15 -53.34 28.34 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 124.255 1.022 . . . . 0.0 110.435 168.624 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.68 -44.24 90.19 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.399 1.08 . . . . 0.0 111.727 -169.269 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -52.44 -60.84 2.75 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.741 0.817 . . . . 0.0 111.005 170.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -57.18 -50.68 72.08 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.884 1.274 . . . . 0.0 110.959 -174.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -43.69 -63.99 0.74 Allowed 'General case' 0 C--O 1.235 0.321 0 C-N-CA 128.226 2.611 . . . . 0.0 111.237 170.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 93.1 mtm-85 -55.63 -46.91 77.35 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 118.341 -0.838 . . . . 0.0 111.133 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.3 m -51.73 -51.27 57.39 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.554 0.741 . . . . 0.0 110.048 -173.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.5 mt -75.95 -57.02 6.86 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 -171.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -61.16 -38.28 85.87 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 118.605 0.639 . . . . 0.0 111.113 -174.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -82.56 -3.4 90.54 Favored Glycine 0 CA--C 1.531 1.079 0 C-N-CA 125.293 1.425 . . . . 0.0 113.723 179.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.52 46.94 1.53 Allowed 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 127.189 2.196 . . . . 0.0 112.291 -168.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 10.8 mt -71.72 145.94 11.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 173.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -126.19 152.93 45.36 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 124.688 1.195 . . . . 0.0 108.592 169.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -139.38 172.54 12.66 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.983 1.713 . . . . 0.0 109.116 -169.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.1 m -145.61 135.06 23.15 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 126.864 2.065 . . . . 0.0 106.725 -170.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 16.1 t -67.13 144.69 98.48 Favored Pre-proline 0 CA--C 1.541 0.612 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 81.1 Cg_exo -62.25 -42.89 26.08 Favored 'Trans proline' 0 N--CA 1.456 -0.688 0 C-N-CA 123.091 2.528 . . . . 0.0 110.869 165.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.17 -131.13 0.08 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.254 1.422 . . . . 0.0 108.816 169.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 16.8 p -132.97 56.25 1.86 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.923 1.289 . . . . 0.0 109.238 -169.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 49.99 75.13 0.18 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 127.383 2.273 . . . . 0.0 110.682 -168.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -130.23 -24.13 2.61 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.077 1.351 . . . . 0.0 112.781 -168.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 39.8 m -65.12 119.22 10.42 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.817 1.247 . . . . 0.0 112.041 -166.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -76.04 102.43 5.67 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 167.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 32.4 mm -71.04 142.53 15.47 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . 0.422 ' H ' ' HB2' ' A' ' 151' ' ' ARG . 82.5 p -135.18 179.43 6.33 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.997 2.119 . . . . 0.0 108.474 171.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 4.1 ptpp? -48.55 -46.82 39.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.816 0.846 . . . . 0.0 112.338 168.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 61.0 ttt85 -67.46 -52.19 42.38 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.881 0.872 . . . . 0.0 109.726 179.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . 0.422 ' HB2' ' H ' ' A' ' 148' ' ' THR . 89.6 mtt180 -76.37 0.29 20.06 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.444 1.098 . . . . 0.0 112.919 -168.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -53.99 -14.4 1.03 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -169.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -136.81 10.82 3.12 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 120.258 1.39 . . . . 0.0 114.262 168.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 40.4 m -58.56 -45.43 88.99 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 123.671 0.788 . . . . 0.0 110.144 169.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 14.5 t -114.19 168.24 10.0 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.894 1.278 . . . . 0.0 107.97 166.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -134.66 -51.54 0.8 Allowed 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 126.578 1.951 . . . . 0.0 108.319 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -56.44 -57.74 11.01 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.302 1.041 . . . . 0.0 111.015 173.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 95.8 m -52.21 -43.93 64.48 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 124.137 0.975 . . . . 0.0 111.491 172.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -54.3 -52.8 60.31 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 123.733 0.813 . . . . 0.0 110.957 178.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -62.27 -48.22 80.87 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.859 0.864 . . . . 0.0 110.511 -177.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 26.2 mmt -59.26 -46.81 87.5 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 123.383 0.673 . . . . 0.0 111.167 178.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -61.17 -47.06 87.92 Favored 'General case' 0 C--O 1.225 -0.2 0 CA-C-O 118.305 -0.855 . . . . 0.0 109.786 177.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.37 -55.94 15.82 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.872 0.869 . . . . 0.0 110.806 178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 13.3 mt -49.22 -54.48 16.44 Favored 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 124.2 1.0 . . . . 0.0 111.396 172.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -54.88 -56.96 13.82 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 124.54 1.136 . . . . 0.0 111.093 -176.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.7 m -64.35 -42.77 96.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 118.411 0.551 . . . . 0.0 110.473 -171.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 146.55 64.27 0.01 OUTLIER Glycine 0 C--N 1.338 0.659 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 93.4 mtp -127.92 83.04 2.12 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 168.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 10.8 mp -76.23 129.3 36.5 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -170.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 14.8 tmtt? -49.92 -35.23 23.1 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 125.058 1.343 . . . . 0.0 111.821 169.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -42.15 -40.57 2.38 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.711 2.005 . . . . 0.0 112.703 173.175 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -62.31 -35.58 91.84 Favored Glycine 0 CA--C 1.531 1.083 0 C-N-CA 124.316 0.96 . . . . 0.0 113.257 -178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 47.3 t -73.13 133.28 32.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 123.971 0.908 . . . . 0.0 109.389 -168.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -89.49 97.17 11.04 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 126.685 1.994 . . . . 0.0 108.281 -169.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -55.39 -33.5 63.53 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.747 1.219 . . . . 0.0 110.131 167.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -60.02 -13.48 11.68 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 127.416 2.287 . . . . 0.0 113.234 175.017 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 21.6 ttt85 64.66 60.18 0.89 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 110.599 166.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 5.2 m -138.54 137.57 43.3 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 126.441 1.896 . . . . 0.0 107.903 -176.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 57.2 mtt180 -81.95 174.08 11.61 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 123.196 0.598 . . . . 0.0 111.951 -171.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 56.22 21.99 34.86 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 126.882 2.182 . . . . 0.0 117.5 165.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -86.73 75.93 2.16 Favored Glycine 0 CA--C 1.524 0.619 0 CA-C-N 119.338 1.569 . . . . 0.0 109.853 -174.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -49.35 116.08 1.58 Allowed 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.292 1.837 . . . . 0.0 111.058 -168.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -69.38 132.05 45.77 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -130.94 121.99 26.13 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 104.933 -2.247 . . . . 0.0 104.933 167.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -65.07 173.29 2.48 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.253 0.621 . . . . 0.0 111.056 178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 98.5 mttt . . . . . 0 N--CA 1.47 0.554 0 C-N-CA 129.952 3.301 . . . . 0.0 114.103 -165.262 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.219 1 O4'-C1'-N19 111.36 4.45 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.946 0 P-O3'-C3' 123.47 3.142 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.542 0 P-O3'-C3' 123.561 3.217 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.93 1 O4'-C1'-N19 111.202 4.252 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.574 2 O4'-C1'-N19 112.488 5.86 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.339 0 O4'-C1'-N19 110.86 3.825 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.056 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.896 0 O4'-C1'-N19 110.481 3.351 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.604 1 O4'-C1'-N19 113.471 7.089 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.308 1 O4'-C1'-N19 113.767 7.459 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.21 0 O4'-C1'-N19 110.55 3.438 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.793 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.311 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.002 1 O4'-C1'-N19 111.331 4.413 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.928 0 O4'-C1'-N19 110.051 2.814 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.753 1 O4'-C1'-N19 111.154 4.192 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.858 0 O4'-C1'-N19 110.839 3.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.723 1 P-O3'-C3' 126.464 5.636 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.931 1 O4'-C1'-N19 113.204 6.755 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 1 O4'-C1'-N19 111.52 4.65 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.512 0 O4'-C1'-N19 110.004 2.755 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.358 0 P-O3'-C3' 124.32 3.85 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.236 1 O4'-C1'-N19 113.102 6.628 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.102 0 O4'-C1'-N19 110.533 3.416 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.843 0 O4'-C1'-N19 110.258 3.072 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.968 0 O4'-C1'-N19 110.429 3.287 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.403 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 49.3 pt -66.2 156.13 85.7 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 123.054 0.541 . . . . 0.0 110.31 169.324 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -69.16 130.26 19.75 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 122.109 1.873 . . . . 0.0 108.782 167.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -64.88 156.4 31.06 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.245 -0.65 . . . . 0.0 109.245 169.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 52.2 ttm-85 -119.98 43.38 2.69 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.695 0.759 . . . . 0.0 109.687 169.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 59.0 mt -120.33 113.99 21.19 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 168.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 45.7 t -52.7 134.3 36.27 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 176.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 47.0 tp -59.99 -39.84 87.09 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.978 1.311 . . . . 0.0 111.106 -177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 t -90.06 -72.08 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.697 0 C-N-CA 124.294 1.038 . . . . 0.0 110.517 -169.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 1.7 p -71.96 -39.28 69.46 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.685 1.129 . . . . 0.0 112.379 -176.162 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 83.7 74.42 1.22 Allowed Glycine 0 C--N 1.335 0.478 0 N-CA-C 108.551 -1.82 . . . . 0.0 108.551 -169.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -140.22 163.75 31.91 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.135 1.774 . . . . 0.0 108.409 -177.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.2 106.6 0.64 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 169.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.4 147.66 47.71 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.761 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.3 p -64.92 -37.06 86.37 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.145 0.578 . . . . 0.0 110.529 168.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.86 -157.46 22.61 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 168.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 2.7 m-85 -78.3 129.85 35.51 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 166.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 47.4 m-70 -131.93 136.01 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.508 1.123 . . . . 0.0 109.295 168.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 50.58 47.17 24.66 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.767 1.227 . . . . 0.0 108.907 -166.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 64.63 14.18 57.29 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.945 1.26 . . . . 0.0 115.439 169.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.92 158.91 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.417 0 CA-C-N 119.613 1.707 . . . . 0.0 108.749 169.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.64 121.59 12.0 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 118.788 0.722 . . . . 0.0 109.866 178.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 57.9 m -154.62 138.32 16.12 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 124.446 1.099 . . . . 0.0 110.11 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 8.4 m -61.09 168.01 2.71 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.674 1.589 . . . . 0.0 112.192 169.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 57.1 mm-40 -62.8 -44.84 95.11 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.871 0.868 . . . . 0.0 110.42 168.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -62.48 -49.44 75.36 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.681 0.793 . . . . 0.0 110.985 179.418 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 97.4 m -47.98 -57.05 6.25 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.566 1.947 . . . . 0.0 112.042 170.285 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -45.4 -58.15 3.54 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 124.74 1.216 . . . . 0.0 110.763 171.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -65.25 -48.17 74.2 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.778 0.831 . . . . 0.0 112.084 -170.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 70.9 t80 -52.61 -54.75 28.9 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.666 0.786 . . . . 0.0 110.114 173.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -59.99 -50.49 73.52 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 -173.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 19.3 pttp -62.36 -41.14 98.37 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.434 -0.791 . . . . 0.0 112.842 -175.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -52.08 -53.65 39.79 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.68 0.673 . . . . 0.0 109.745 169.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 28.2 m -53.56 -47.87 69.66 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.446 0.698 . . . . 0.0 110.989 -178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 32.9 mm -65.13 -67.83 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.157 0.983 . . . . 0.0 109.298 -178.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -63.47 -37.64 88.08 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.529 0.732 . . . . 0.0 110.469 -169.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -78.78 -9.82 86.74 Favored Glycine 0 CA--C 1.531 1.056 0 C-N-CA 125.708 1.623 . . . . 0.0 113.749 179.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 41.24 50.63 3.43 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.697 1.999 . . . . 0.0 111.796 -167.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 33.0 mm -72.01 135.19 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 82.0 mm-40 -101.82 150.81 22.78 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 124.543 1.137 . . . . 0.0 109.184 169.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 48.7 m-85 -137.9 172.21 13.27 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.904 1.682 . . . . 0.0 109.394 -176.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.2 m -154.1 125.16 7.3 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 127.254 2.221 . . . . 0.0 105.997 168.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 20.1 t -67.0 141.58 96.75 Favored Pre-proline 0 CA--C 1.542 0.65 0 C-N-CA 123.198 0.599 . . . . 0.0 109.479 171.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -61.87 -38.62 57.62 Favored 'Trans proline' 0 N--CA 1.458 -0.609 0 C-N-CA 123.26 2.64 . . . . 0.0 111.397 165.685 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -89.57 -141.31 0.14 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.661 1.584 . . . . 0.0 109.865 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 1.8 m -62.95 -28.28 69.97 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.287 1.835 . . . . 0.0 113.048 -166.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 60.22 26.33 15.77 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.641 1.576 . . . . 0.0 111.339 -168.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -142.19 23.4 2.02 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.255 1.822 . . . . 0.0 109.096 170.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 43.8 m -70.5 138.41 51.03 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.296 1.438 . . . . 0.0 110.719 -167.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -68.22 115.75 8.03 Favored 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 169.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 48.4 mm -69.55 140.51 18.6 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.334 0.587 . . . . 0.0 109.652 175.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.3 p -131.4 179.22 6.16 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 127.704 2.401 . . . . 0.0 106.542 167.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -51.26 -42.64 61.19 Favored 'General case' 0 N--CA 1.466 0.36 0 O-C-N 121.282 -0.886 . . . . 0.0 111.954 168.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -60.25 -60.89 3.1 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 123.058 0.543 . . . . 0.0 109.718 175.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 22.7 mmm180 -69.73 -17.44 63.45 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 117.582 -1.199 . . . . 0.0 112.683 -169.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 29.8 ttm180 -34.33 -58.48 0.47 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.549 1.939 . . . . 0.0 111.338 173.516 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -70.18 -55.64 8.83 Favored 'General case' 0 C--O 1.232 0.143 0 C-N-CA 122.621 0.368 . . . . 0.0 111.096 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.0 m -60.42 -55.84 28.67 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.841 1.256 . . . . 0.0 110.743 -167.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.433 ' HB3' ' HB2' ' A' ' 158' ' ' CYS . 72.1 m -86.44 69.66 10.42 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.865 1.266 . . . . 0.0 109.292 -173.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -57.14 -51.01 71.02 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.343 0.657 . . . . 0.0 110.035 177.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -59.66 -53.25 60.19 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.548 1.139 . . . . 0.0 110.8 -178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.433 ' HB2' ' HB3' ' A' ' 155' ' ' CYS . 8.8 m -60.82 -38.64 86.12 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.903 0.881 . . . . 0.0 109.096 -177.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 33.1 ttt-85 -63.48 -51.16 66.75 Favored 'General case' 0 C--N 1.341 0.22 0 CA-C-O 118.128 -0.939 . . . . 0.0 110.385 179.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -54.16 -49.94 68.13 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.249 0.931 . . . . 0.0 110.898 177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 13.1 tpt -50.01 -57.23 8.0 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.122 1.369 . . . . 0.0 111.444 171.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -58.1 -50.6 72.91 Favored 'General case' 0 C--O 1.223 -0.291 0 C-N-CA 124.315 1.046 . . . . 0.0 109.331 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.52 -55.52 18.55 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 125.961 1.704 . . . . 0.0 110.696 -171.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 11.8 mt -51.3 -51.76 51.34 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 124.744 1.217 . . . . 0.0 112.203 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -56.32 -57.39 12.45 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 123.892 0.877 . . . . 0.0 110.226 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 26.8 m -65.14 -44.14 95.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 CA-C-O 118.829 -0.605 . . . . 0.0 110.877 -169.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 156.88 5.29 0.07 OUTLIER Glycine 0 CA--C 1.529 0.964 0 CA-C-O 117.964 -1.464 . . . . 0.0 116.188 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.3 mtp -75.13 93.43 2.78 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 120.358 2.079 . . . . 0.0 105.702 167.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 17.6 mt -74.98 154.17 38.21 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 -177.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 1.5 tmmt? -52.52 -43.57 65.21 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 165.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -62.72 -17.66 61.16 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.603 1.561 . . . . 0.0 113.739 175.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -54.37 -59.02 10.72 Favored Glycine 0 CA--C 1.529 0.932 0 C-N-CA 125.195 1.379 . . . . 0.0 110.917 169.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 97.8 t -68.49 163.4 3.15 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 126.055 1.742 . . . . 0.0 109.262 169.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -126.05 137.27 53.63 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.111 -0.993 . . . . 0.0 108.854 168.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 95.9 mt -70.45 -22.17 62.72 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.422 1.089 . . . . 0.0 111.7 -177.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -76.8 -1.85 30.27 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.218 1.407 . . . . 0.0 113.155 -168.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 49.89 46.87 23.86 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 126.874 2.07 . . . . 0.0 111.145 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 35.9 m -79.29 -168.06 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.45 0 C-N-CA 124.411 1.085 . . . . 0.0 108.904 170.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -141.33 169.5 17.48 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.799 1.24 . . . . 0.0 109.374 167.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 45.51 65.98 1.73 Allowed Glycine 0 C--N 1.337 0.59 0 C-N-CA 126.788 2.137 . . . . 0.0 113.063 168.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -131.67 73.3 0.46 Allowed Glycine 0 C--N 1.335 0.518 0 N-CA-C 109.277 -1.529 . . . . 0.0 109.277 -173.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.5 mtt180 -39.94 108.98 0.1 Allowed 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 126.47 1.908 . . . . 0.0 111.9 -167.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -73.91 133.77 43.13 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -148.78 105.99 3.62 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 106.265 -1.754 . . . . 0.0 106.265 175.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 83.0 m-85 -66.11 141.17 58.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.202 0.525 . . . . 0.0 109.953 -176.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 61.0 pttt . . . . . 0 C--O 1.237 0.4 0 C-N-CA 126.811 2.044 . . . . 0.0 108.286 -178.457 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.253 0 O4'-C1'-N19 110.651 3.564 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.549 4.718 1 O4'-C1'-N19 111.668 4.835 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.422 1 O4'-C1'-N19 111.448 4.56 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.057 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.891 1 O4'-C1'-N19 113.053 6.566 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.758 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.206 1 O4'-C1'-N19 114.909 8.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.436 0 P-O3'-C3' 123.237 2.948 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.233 3.041 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.587 0 P-O3'-C3' 123.573 3.227 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.994 1 O4'-C1'-N19 113.317 6.896 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.314 1 O4'-C1'-N19 111.167 4.209 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.294 0 O4'-C1'-N19 110.672 3.59 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.139 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.982 0 P-O3'-C3' 123.396 3.08 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.918 0 O4'-C1'-N19 110.818 3.773 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.83 0 O4'-C1'-N19 110.271 3.089 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.037 1 O4'-C1'-N19 112.617 6.021 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.254 1 O4'-C1'-N19 111.208 4.26 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.074 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.668 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.69 0 P-O3'-C3' 123.505 3.171 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.834 1 O4'-C1'-N19 113.395 6.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.499 0 O4'-C1'-N19 110.482 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.543 1 O4'-C1'-N19 112.214 5.518 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.292 1 O4'-C1'-N19 112.272 5.59 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.38 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 45.6 pt -138.79 158.59 69.75 Favored Pre-proline 0 CA--C 1.539 0.529 0 C-N-CA 125.531 1.532 . . . . 0.0 109.373 -170.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.67 142.09 43.1 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 122.512 2.141 . . . . 0.0 109.75 167.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.39 166.5 30.85 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.581 1.552 . . . . 0.0 109.157 172.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 53.8 mtt85 -127.23 98.87 5.44 Favored 'General case' 0 C--O 1.232 0.18 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 169.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 60.3 tp -142.42 111.98 6.72 Favored 'General case' 0 N--CA 1.452 -0.342 0 N-CA-C 106.501 -1.666 . . . . 0.0 106.501 169.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 37.0 t -62.42 130.79 46.81 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 169.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -65.99 -41.22 91.39 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.869 0.868 . . . . 0.0 110.43 -172.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.4 m -73.28 -69.48 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 CA-C-O 119.027 -0.511 . . . . 0.0 110.553 -173.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 2.2 p -78.52 -24.24 45.85 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 119.263 0.938 . . . . 0.0 113.153 -169.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.59 64.29 3.14 Favored Glycine 0 CA--C 1.527 0.823 0 N-CA-C 108.764 -1.734 . . . . 0.0 108.764 -168.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -136.11 160.09 39.71 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 127.018 2.127 . . . . 0.0 107.022 178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 81.2 mt -66.25 110.18 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -59.95 140.66 56.57 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.469 171.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 8.7 p -61.9 -44.53 96.61 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 123.725 0.81 . . . . 0.0 110.175 169.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -179.55 -169.24 39.64 Favored Glycine 0 CA--C 1.526 0.734 0 C-N-CA 123.703 0.668 . . . . 0.0 111.731 174.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -64.03 113.99 3.85 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.421 1.488 . . . . 0.0 108.025 169.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 39.7 m80 -141.18 129.41 22.23 Favored 'General case' 0 C--O 1.232 0.184 0 C-N-CA 126.279 1.832 . . . . 0.0 107.94 -179.342 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 47.72 44.82 17.98 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.977 1.311 . . . . 0.0 110.336 -166.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 75.43 6.23 79.95 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 124.827 1.203 . . . . 0.0 115.824 167.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 3.4 m -139.6 164.95 23.3 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.374 0 CA-C-N 120.038 1.919 . . . . 0.0 108.496 169.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -57.97 120.64 8.88 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 169.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 53.3 m -149.73 145.25 26.56 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 123.91 0.884 . . . . 0.0 110.187 169.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 6.2 m -61.26 165.05 4.8 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.208 1.403 . . . . 0.0 111.974 173.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -58.75 -44.55 90.59 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.313 1.445 . . . . 0.0 110.327 168.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.473 ' HB2' " H2'" ' C' ' 17' ' ' ' DG' . . . -68.95 -44.46 72.97 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.481 0.712 . . . . 0.0 111.029 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 67.5 m -55.19 -52.85 62.02 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.816 1.646 . . . . 0.0 111.144 171.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -45.26 -59.99 2.36 Favored 'General case' 0 C--N 1.34 0.19 0 C-N-CA 124.207 1.003 . . . . 0.0 110.061 169.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.02 -52.0 65.79 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.946 0.898 . . . . 0.0 111.671 -173.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -55.88 -56.17 23.8 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.013 0.925 . . . . 0.0 110.708 176.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -59.94 -52.57 64.86 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.021 0.928 . . . . 0.0 109.827 -172.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 31.8 ttpt -41.52 -59.33 1.63 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.641 1.977 . . . . 0.0 112.221 171.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 36.1 mtp-105 -54.61 -51.25 65.93 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 118.87 -0.586 . . . . 0.0 109.85 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 19.2 m -50.68 -48.47 58.51 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 123.708 0.803 . . . . 0.0 110.582 179.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 3.2 mm -70.06 -65.98 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.19 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 -172.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 29.3 mm100 -74.69 -26.74 60.04 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 122.246 -0.283 . . . . 0.0 111.617 -167.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.14 -10.3 86.33 Favored Glycine 0 CA--C 1.532 1.127 0 C-N-CA 124.711 1.148 . . . . 0.0 113.538 169.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 40.85 52.33 3.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.18 2.192 . . . . 0.0 111.96 -168.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 31.1 mm -74.83 125.19 33.98 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 -171.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 64.7 mm-40 -84.15 140.84 31.49 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 168.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -134.35 162.64 31.65 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.977 1.311 . . . . 0.0 109.846 176.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 63.3 m -153.9 126.28 8.01 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 128.462 2.705 . . . . 0.0 105.297 168.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 9.1 t -65.8 141.84 97.88 Favored Pre-proline 0 CA--C 1.542 0.642 0 C-N-CA 123.404 0.682 . . . . 0.0 109.497 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -59.23 -36.87 94.2 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 123.422 2.748 . . . . 0.0 111.729 166.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -84.07 -146.19 0.09 Allowed 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.888 1.275 . . . . 0.0 109.945 -176.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 14.3 t -71.8 -18.42 62.1 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.801 1.241 . . . . 0.0 112.268 -168.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 56.28 35.57 26.03 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.812 1.645 . . . . 0.0 111.129 -172.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -138.93 19.26 2.64 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 127.97 2.508 . . . . 0.0 108.392 169.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 35.3 m -70.51 142.9 51.81 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 126.089 1.755 . . . . 0.0 112.323 -166.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -80.15 149.17 30.64 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.166 -1.42 . . . . 0.0 107.166 165.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 25.3 mm -102.01 139.48 22.99 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 179.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 69.5 p -131.75 177.87 7.19 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.293 1.837 . . . . 0.0 107.447 169.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -52.93 -45.57 67.72 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 121.171 -0.956 . . . . 0.0 111.097 168.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 96.6 mtt-85 -59.57 -60.35 3.98 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 123.119 0.568 . . . . 0.0 109.896 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.0 mtp85 -69.59 -11.25 60.69 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-O 118.795 -0.622 . . . . 0.0 112.611 -169.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 37.6 ttp180 -49.66 -36.23 24.14 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.24 1.016 . . . . 0.0 111.676 167.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 9.7 tttm -93.24 -20.25 20.61 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 177.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 14.8 m -68.85 -68.83 0.37 Allowed 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.097 0.862 . . . . 0.0 110.238 172.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 86.7 m -77.14 160.21 29.18 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 124.805 1.242 . . . . 0.0 110.756 -171.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 90.7 mt-30 -136.54 -61.1 0.69 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 125.069 1.348 . . . . 0.0 108.672 171.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -55.1 -49.67 71.13 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.966 0.907 . . . . 0.0 111.105 178.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 9.7 m -58.66 -38.56 78.43 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.637 1.575 . . . . 0.0 111.163 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 84.2 mtp180 -60.22 -54.04 50.48 Favored 'General case' 0 CA--C 1.518 -0.281 0 CA-C-O 118.834 -0.603 . . . . 0.0 109.971 176.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -58.26 -44.54 88.43 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.824 0.45 . . . . 0.0 110.82 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 48.7 ttm -53.06 -56.39 16.5 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.168 0.987 . . . . 0.0 111.123 172.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -59.79 -45.93 90.78 Favored 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 123.545 0.738 . . . . 0.0 110.002 -177.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.09 -56.96 10.03 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.618 1.567 . . . . 0.0 110.366 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 15.9 mt -52.82 -49.57 65.44 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.672 0.789 . . . . 0.0 111.599 174.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 60.3 tttp -55.95 -56.05 25.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.801 0.84 . . . . 0.0 111.335 -179.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 35.1 m -65.28 -40.1 87.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 CA-C-N 118.564 0.62 . . . . 0.0 110.835 -173.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.52 12.02 0.24 Allowed Glycine 0 CA--C 1.529 0.957 0 CA-C-O 118.868 -0.962 . . . . 0.0 114.577 168.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 86.9 mtp -74.71 93.78 2.62 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 105.361 -2.089 . . . . 0.0 105.361 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 42.4 mt -70.52 149.6 46.99 Favored 'General case' 0 C--O 1.233 0.204 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -43.88 -56.4 3.91 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 125.181 1.392 . . . . 0.0 109.755 168.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -72.14 -1.3 14.45 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 113.396 0.888 . . . . 0.0 113.396 -176.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -49.95 -49.32 36.08 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 109.774 -1.331 . . . . 0.0 109.774 167.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 8.1 t -72.73 117.06 15.72 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 166.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.24 141.79 45.37 Favored 'General case' 0 C--N 1.333 -0.127 0 N-CA-C 108.29 -1.004 . . . . 0.0 108.29 -172.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.97 -40.41 73.22 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.232 1.013 . . . . 0.0 110.326 169.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -64.77 -24.98 67.73 Favored 'General case' 0 N--CA 1.463 0.222 0 C-N-CA 126.446 1.898 . . . . 0.0 111.872 -170.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 71.2 mtm180 56.31 60.35 3.2 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 124.881 1.272 . . . . 0.0 111.587 166.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 3.1 m -117.37 101.31 11.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 -178.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -58.61 131.07 49.72 Favored 'General case' 0 C--N 1.343 0.321 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 170.507 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 82.57 85.55 0.79 Allowed Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 108.218 -1.953 . . . . 0.0 108.218 -165.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -151.42 -172.93 20.78 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 168.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 66.6 mtt-85 -137.33 156.1 48.63 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 107.818 -1.179 . . . . 0.0 107.818 168.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 5.1 tp-100 -126.32 159.16 33.92 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 126.501 1.921 . . . . 0.0 108.535 -178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.97 171.11 15.75 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 124.092 0.957 . . . . 0.0 110.794 170.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -138.28 162.0 35.44 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 125.394 1.477 . . . . 0.0 108.785 169.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 27.6 mmtm . . . . . 0 C--O 1.238 0.458 0 C-N-CA 125.986 1.714 . . . . 0.0 108.014 168.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.017 1 O4'-C1'-N19 115.143 9.179 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.118 0 O4'-C1'-N19 110.752 3.689 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.727 0 P-O3'-C3' 123.483 3.153 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.817 1 O4'-C1'-N19 112.162 5.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.138 1 O4'-C1'-N19 112.26 5.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.221 1 O4'-C1'-N19 111.696 4.869 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.997 1 O4'-C1'-N19 114.293 8.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.003 0 O4'-C1'-N19 110.879 3.848 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.273 1 O4'-C1'-N19 113.131 6.664 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.125 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.238 1 O4'-C1'-N19 113.119 6.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 111.029 4.037 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.293 0 O4'-C1'-N19 110.636 3.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.807 1 O4'-C1'-N19 114.058 7.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.481 1 O4'-C1'-N19 112.763 6.204 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.173 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . 0.473 " H2'" ' HB2' ' A' ' 122' ' ' ALA . . . . . . . . 0 C5'--C4' 1.536 3.109 1 O4'-C1'-N19 113.434 7.042 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.478 1 O4'-C1'-N19 112.464 5.829 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.862 0 O4'-C1'-N19 110.238 3.047 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.071 1 O4'-C1'-N19 111.557 4.696 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 1 O4'-C1'-N19 111.34 4.425 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.364 0 O4'-C1'-N19 109.583 2.228 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.705 1 O4'-C1'-N19 112.262 5.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.431 3.288 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.543 4.007 1 O4'-C1'-N19 112.781 6.226 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 018 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.415 1 O4'-C1'-N19 112.313 5.641 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.379 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -64.68 152.14 90.67 Favored Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 123.407 0.683 . . . . 0.0 110.692 169.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -57.42 146.99 80.57 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 122.899 2.399 . . . . 0.0 111.654 166.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.47 152.39 51.31 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.844 1.258 . . . . 0.0 109.774 -175.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.43 123.9 21.27 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 -175.192 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -111.42 153.18 26.47 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 125.221 1.408 . . . . 0.0 109.951 169.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 48.2 t -66.78 119.89 12.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 167.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -63.92 -26.92 68.81 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.461 0.704 . . . . 0.0 111.226 -179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 61.1 t -68.63 -76.77 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.102 0.961 . . . . 0.0 109.103 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 12.7 p -81.37 -22.94 38.02 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 113.297 0.851 . . . . 0.0 113.297 -168.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.26 65.38 2.62 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 110.217 -1.153 . . . . 0.0 110.217 -169.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 40.6 t0 -143.03 154.79 44.34 Favored 'General case' 0 N--CA 1.464 0.239 0 C-N-CA 126.12 1.768 . . . . 0.0 107.872 169.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 89.8 mt -60.73 123.32 13.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.391 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 -173.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -72.99 142.97 47.75 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 123.634 0.773 . . . . 0.0 109.573 -174.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.4 p -66.95 -47.07 72.77 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.091 0.956 . . . . 0.0 110.362 168.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -173.77 176.87 46.27 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 -170.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -69.14 126.1 28.73 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 169.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -138.04 131.16 30.23 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 125.541 1.536 . . . . 0.0 107.652 171.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 47.09 48.12 15.83 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.841 -166.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 66.77 15.5 64.56 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 125.868 1.699 . . . . 0.0 114.911 167.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 6.8 t -137.34 147.12 26.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.321 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 169.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -54.91 116.47 2.76 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 168.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 4.6 m -151.96 150.78 30.39 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 125.487 1.515 . . . . 0.0 108.828 -174.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 5.6 m -62.17 157.88 18.22 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 119.093 0.861 . . . . 0.0 111.884 171.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -69.38 -33.83 73.63 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.486 1.114 . . . . 0.0 111.851 171.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.82 61.8 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.557 -0.714 . . . . 0.0 111.146 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 75.7 m -51.6 -54.11 31.16 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.192 1.397 . . . . 0.0 110.907 170.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.35 -59.64 2.3 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.42 1.488 . . . . 0.0 109.719 168.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -59.82 -46.16 90.1 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 118.581 0.628 . . . . 0.0 110.799 -169.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.9 -45.78 84.48 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.072 -177.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -55.8 -49.71 72.46 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.832 1.253 . . . . 0.0 111.635 172.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 25.8 ttpt -51.56 -56.5 13.12 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.348 1.059 . . . . 0.0 110.467 175.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 64.7 mtt180 -57.17 -42.32 80.9 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.624 1.17 . . . . 0.0 111.081 -176.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 32.8 m -50.78 -57.33 8.64 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.655 0.782 . . . . 0.0 110.426 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 38.6 mt -74.06 -51.13 25.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 C-N-CA 123.797 0.839 . . . . 0.0 110.06 -168.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 93.1 mt-30 -55.98 -43.82 77.96 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.971 0.805 . . . . 0.0 110.954 176.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -77.02 0.16 67.72 Favored Glycine 0 CA--C 1.531 1.055 0 CA-C-O 118.557 -1.135 . . . . 0.0 113.524 -179.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER 31.15 51.63 0.14 Allowed 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.3 3.04 . . . . 0.0 111.577 -165.633 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 26.4 mm -70.45 145.93 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 C-N-CA 126.021 1.728 . . . . 0.0 107.464 174.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.51 153.67 46.06 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 124.968 1.307 . . . . 0.0 107.843 169.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 47.0 m-85 -140.1 164.24 30.58 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.796 1.239 . . . . 0.0 110.571 -168.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 50.6 m -149.95 123.12 8.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 128.088 2.555 . . . . 0.0 105.667 169.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 2.3 t -70.93 141.43 86.88 Favored Pre-proline 0 CA--C 1.542 0.669 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 169.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.52 -20.38 15.92 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.117 2.545 . . . . 0.0 112.488 169.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -77.76 -145.01 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.321 1.049 . . . . 0.0 109.901 169.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 25.4 p -71.19 -19.56 62.38 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.157 1.383 . . . . 0.0 112.155 -169.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 60.96 26.31 16.25 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 126.088 1.755 . . . . 0.0 110.556 -166.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -142.48 34.37 1.46 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.724 1.61 . . . . 0.0 109.165 172.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 84.5 m -63.6 132.98 52.9 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 123.871 0.868 . . . . 0.0 109.991 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -73.33 132.22 42.81 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 167.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 37.8 mm -90.61 145.37 7.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 -169.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 71.7 p -135.47 172.26 13.26 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 125.687 1.595 . . . . 0.0 108.371 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -49.23 -41.86 38.7 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.028 0.931 . . . . 0.0 111.358 168.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 78.8 ttt180 -64.66 -63.64 1.07 Allowed 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 123.253 0.621 . . . . 0.0 110.781 172.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 58.2 mtp85 -66.93 -20.4 65.89 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 117.947 -1.025 . . . . 0.0 113.472 -166.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -50.56 -37.89 42.07 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.069 1.304 . . . . 0.0 114.238 -172.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 11.4 ptmm? -83.88 -39.0 20.42 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.034 0.834 . . . . 0.0 111.457 175.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 12.5 m -69.71 -60.24 2.44 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.568 1.547 . . . . 0.0 110.817 -171.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . . . . . . . . . 1.5 m -62.2 146.12 51.64 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 124.02 0.928 . . . . 0.0 109.224 169.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -138.92 -64.14 0.51 Allowed 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 125.729 1.611 . . . . 0.0 107.976 -167.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -57.2 -55.73 31.01 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.082 0.953 . . . . 0.0 110.596 171.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . . . . . . . . . 27.3 m -56.48 -44.96 81.14 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.273 1.429 . . . . 0.0 111.166 176.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 7.7 tmm_? -60.77 -50.28 74.11 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 123.342 0.657 . . . . 0.0 110.654 179.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 68.2 t80 -55.21 -49.53 71.71 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.135 0.974 . . . . 0.0 110.99 176.129 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 51.9 ttm -54.09 -52.62 60.39 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.185 0.994 . . . . 0.0 110.966 174.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 51.3 tptt -55.6 -52.64 63.08 Favored 'General case' 0 C--O 1.226 -0.161 0 C-N-CA 125.437 1.495 . . . . 0.0 108.961 -178.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -52.77 -56.0 18.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 124.621 1.168 . . . . 0.0 110.728 -178.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 17.4 mt -53.83 -50.76 65.47 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.565 0.746 . . . . 0.0 111.395 174.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -56.87 -53.74 54.44 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 124.461 1.104 . . . . 0.0 111.032 -176.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 33.0 m -63.64 -39.57 85.85 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-N 118.504 0.593 . . . . 0.0 110.657 -175.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 143.13 19.58 0.22 Allowed Glycine 0 CA--C 1.526 0.765 0 CA-C-O 118.601 -1.111 . . . . 0.0 114.529 167.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 89.2 mtp -78.03 93.48 4.49 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 105.306 -2.109 . . . . 0.0 105.306 167.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -67.52 133.35 49.31 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -57.33 -19.63 23.66 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 168.409 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -48.99 -41.78 35.6 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.604 1.562 . . . . 0.0 111.505 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -55.14 -58.57 13.13 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 124.484 1.04 . . . . 0.0 111.234 -175.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 72.9 t -56.23 130.15 18.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 125.159 1.384 . . . . 0.0 109.769 -170.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -96.59 104.13 16.09 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -172.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -69.67 -23.75 63.5 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.825 0.85 . . . . 0.0 109.149 163.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.3 -15.51 63.29 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.434 1.893 . . . . 0.0 112.279 169.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 89.7 mtt-85 52.06 60.12 4.06 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 125.703 1.601 . . . . 0.0 111.068 170.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.2 138.29 24.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 C-N-CA 125.087 1.355 . . . . 0.0 107.674 -169.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.637 ' NH1' ' H ' ' A' ' 180' ' ' GLY . 2.6 mmp_? -76.14 171.91 13.7 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-O 122.031 0.919 . . . . 0.0 111.473 -170.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . 0.637 ' H ' ' NH1' ' A' ' 179' ' ' ARG . . . 32.91 56.4 0.5 Allowed Glycine 0 C--N 1.335 0.514 1 C-N-CA 131.479 4.371 . . . . 0.0 113.518 -169.515 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . -82.04 64.44 4.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 109.687 -1.365 . . . . 0.0 109.687 168.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -55.33 123.85 15.16 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 174.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 14.6 tp60 -129.31 46.69 2.59 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 127.638 2.375 . . . . 0.0 107.544 173.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 10.8 tppt? -65.88 111.28 3.21 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 167.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -64.56 140.73 58.9 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -178.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 19.3 ptpt . . . . . 0 C--O 1.235 0.341 0 C-N-CA 124.829 1.252 . . . . 0.0 109.532 174.514 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.545 4.27 1 O4'-C1'-N19 111.331 4.414 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.986 0 O4'-C1'-N19 110.424 3.28 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.451 0 P-O3'-C3' 123.487 3.155 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.556 1 O4'-C1'-N19 111.806 5.008 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.366 2 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.22 1 O4'-C1'-N19 112.711 6.139 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.825 1 O4'-C1'-N19 113.259 6.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.024 1 P-O3'-C3' 124.901 4.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 2.989 1 O4'-C1'-N19 113.286 6.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.131 0 O4'-C1'-N19 110.241 3.051 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.053 1 O4'-C1'-N19 113.446 7.057 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.775 1 O4'-C1'-N19 112.693 6.116 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.539 3.466 1 O4'-C1'-N19 112.596 5.995 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.164 0 O4'-C1'-N19 110.85 3.813 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.104 0 P-O3'-C3' 123.167 2.889 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.799 0 O5'-C5'-C4' 114.629 3.164 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.343 1 O4'-C1'-N19 111.739 4.923 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.073 0 P-O3'-C3' 123.939 3.532 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.917 1 O4'-C1'-N19 113.07 6.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.427 0 O4'-C1'-N19 110.075 2.843 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.873 0 C4'-C3'-O3' 118.921 3.919 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.021 1 P-O3'-C3' 126.555 5.712 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.4 2 O4'-C1'-N19 111.654 4.817 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.146 0 O4'-C1'-N19 110.589 3.486 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.071 0 O4'-C1'-N19 110.481 3.352 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.157 0 O4'-C1'-N19 110.274 3.092 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.34 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 1.7 pp -134.4 162.53 57.17 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.953 1.701 . . . . 0.0 109.31 169.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_exo -55.31 137.6 77.59 Favored 'Trans proline' 0 N--CA 1.456 -0.679 0 C-N-CA 123.182 2.588 . . . . 0.0 111.833 168.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -61.43 146.25 49.02 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 167.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -70.56 90.51 0.75 Allowed 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.641 0.734 . . . . 0.0 110.743 -169.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 3.5 pp -134.1 137.6 44.69 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 126.448 1.899 . . . . 0.0 106.89 168.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' CYS . . . . . . . . . . . . . 31.5 t -66.17 112.16 3.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 174.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -73.71 0.19 13.68 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -179.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.5 t -76.04 -72.57 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 167.204 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' CYS . . . . . . . . . . . . . 6.1 p -90.6 -22.23 21.33 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.04 1.336 . . . . 0.0 113.519 -169.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 86.93 2.81 83.68 Favored Glycine 0 CA--C 1.532 1.131 0 C-N-CA 125.066 1.317 . . . . 0.0 113.053 -178.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -72.87 159.53 33.59 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.946 1.373 . . . . 0.0 110.404 169.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ILE . . . . . . . . . . . . . 98.2 mt -57.35 130.38 20.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 125.046 1.338 . . . . 0.0 108.579 172.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -90.18 149.23 22.51 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 124.233 1.013 . . . . 0.0 109.265 169.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 7.1 p -61.82 -44.65 96.43 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 124.518 1.127 . . . . 0.0 110.452 167.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.11 -170.38 40.2 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.105 0.86 . . . . 0.0 111.179 -169.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 3.6 m-85 -71.23 122.16 19.72 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 123.365 0.666 . . . . 0.0 109.689 170.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 9.0 m-70 -135.57 133.99 38.92 Favored 'General case' 0 C--N 1.334 -0.091 0 C-N-CA 125.872 1.669 . . . . 0.0 107.698 169.899 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 48.93 54.91 10.06 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.802 1.641 . . . . 0.0 109.46 -167.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 57.74 17.27 27.09 Favored Glycine 0 CA--C 1.536 1.35 0 C-N-CA 126.681 2.086 . . . . 0.0 116.017 168.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 t -143.66 156.81 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.751 2.02 . . . . 0.0 106.344 171.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -59.79 118.5 6.24 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.08 -1.013 . . . . 0.0 108.681 168.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 69.2 m -156.54 134.14 10.85 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 124.682 1.193 . . . . 0.0 108.899 -176.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' CYS . . . . . . . . . . . . . 26.6 p -74.72 169.02 18.69 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 122.544 1.164 . . . . 0.0 111.962 -169.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -58.15 -41.74 84.4 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.143 1.377 . . . . 0.0 111.598 170.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -69.19 -47.68 64.23 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.577 0.751 . . . . 0.0 111.067 -169.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 99.3 m -59.14 -45.87 89.84 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.29 169.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 22.8 ttpp -51.67 -45.01 63.27 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 119.703 1.138 . . . . 0.0 112.033 173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -56.42 -49.92 73.14 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.517 1.053 . . . . 0.0 112.201 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 60.2 t80 -58.45 -52.43 65.66 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.526 0.731 . . . . 0.0 111.104 172.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -56.05 -55.23 35.42 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 126.176 1.79 . . . . 0.0 110.417 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' LYS . . . . . . . . . . . . . 4.7 ptpt -56.31 -48.9 75.75 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.524 0.73 . . . . 0.0 110.318 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 -58.82 -49.86 76.15 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 123.95 0.9 . . . . 0.0 110.273 -179.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 67.8 m -51.08 -51.28 54.86 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.999 0.919 . . . . 0.0 110.147 178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 60.0 mt -73.94 -56.22 9.93 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -169.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -59.03 -39.54 82.27 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.167 0.587 . . . . 0.0 110.624 -178.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . -84.78 -2.47 88.6 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 125.049 1.309 . . . . 0.0 113.813 -177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 39.22 47.5 1.42 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.184 2.194 . . . . 0.0 112.57 -168.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 12.9 mt -73.88 146.56 10.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -127.45 157.98 38.59 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 125.253 1.421 . . . . 0.0 108.794 172.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 49.1 m-85 -137.53 174.48 10.55 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.185 1.394 . . . . 0.0 110.915 -167.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 71.3 m -151.66 152.99 33.54 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 127.667 2.387 . . . . 0.0 107.503 169.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 6.8 m -120.02 -172.43 0.23 Allowed Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 127.081 2.152 . . . . 0.0 107.297 168.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -57.88 -34.81 98.78 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 122.659 2.239 . . . . 0.0 111.456 167.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -116.17 -156.68 0.62 Allowed 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 125.823 1.649 . . . . 0.0 108.727 168.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 7.9 m -133.71 114.1 13.07 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 169.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 59.33 74.63 0.43 Allowed 'General case' 0 C--O 1.233 0.186 0 C-N-CA 127.152 2.181 . . . . 0.0 111.522 -177.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -137.74 -47.48 0.55 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.289 1.836 . . . . 0.0 110.052 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 80.4 m -53.5 122.59 10.03 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.544 1.138 . . . . 0.0 110.177 -171.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -71.74 115.27 10.74 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 168.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ILE . . . . . . . . . . . . . 20.8 mm -84.88 132.69 31.07 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' THR . . . . . . . . . . . . . 75.7 p -131.14 175.18 9.31 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 126.73 2.012 . . . . 0.0 106.084 167.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -53.88 -40.85 66.94 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 120.767 -1.208 . . . . 0.0 111.432 169.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 36.9 ttm180 -62.31 -66.03 0.6 Allowed 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 123.43 0.692 . . . . 0.0 111.13 169.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 23.2 mmm180 -64.12 -19.19 65.1 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.727 0.811 . . . . 0.0 112.812 -168.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.74 -54.93 7.15 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 124.133 0.973 . . . . 0.0 110.856 168.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . . . . . . . . . 92.3 mttt -61.33 -39.36 90.26 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 118.816 0.734 . . . . 0.0 111.321 -179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' SER . . . . . . . . . . . . . 5.1 m -62.46 -55.35 28.46 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.243 1.017 . . . . 0.0 110.773 -179.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 158' ' ' CYS . 36.8 t -67.02 158.48 30.87 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.709 1.603 . . . . 0.0 110.703 -178.026 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -131.19 -66.17 0.75 Allowed 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.991 1.716 . . . . 0.0 107.821 168.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' ALA . . . . . . . . . . . . . . . -70.95 -53.84 13.48 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.843 0.857 . . . . 0.0 111.891 -168.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' CYS . . . . . 0.408 ' HB2' ' SG ' ' A' ' 155' ' ' CYS . 10.1 m -58.77 -42.71 89.57 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.241 1.017 . . . . 0.0 110.94 -169.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 5.8 ttp180 -45.03 -55.37 5.64 Favored 'General case' 0 C--N 1.333 -0.12 0 C-N-CA 126.241 1.817 . . . . 0.0 112.343 170.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -62.69 -44.71 95.55 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.204 0.911 . . . . 0.0 110.717 -176.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 44.7 tpp -59.88 -44.79 94.01 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 121.907 -0.495 . . . . 0.0 111.208 174.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -56.94 -50.06 73.77 Favored 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 123.947 0.899 . . . . 0.0 109.45 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ALA . . . . . . . . . . . . . . . -51.49 -53.99 31.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.663 1.185 . . . . 0.0 111.254 177.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' LEU . . . . . . . . . . . . . 14.3 mt -51.35 -55.61 17.57 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 123.873 0.869 . . . . 0.0 111.702 172.89 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.25 -52.24 65.2 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 124.193 0.997 . . . . 0.0 111.507 -176.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' VAL . . . . . . . . . . . . . 34.2 m -62.68 -39.91 86.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 118.738 0.699 . . . . 0.0 110.764 -176.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' GLY . . . . . . . . . . . . . . . 145.15 22.15 0.14 Allowed Glycine 0 C--N 1.341 0.81 0 CA-C-O 118.476 -1.18 . . . . 0.0 115.107 167.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' MET . . . . . . . . . . . . . 95.0 mtp -81.31 92.65 6.41 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 167.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -68.76 120.83 15.34 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -35.69 64.81 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.297 0.639 . . . . 0.0 112.19 178.521 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -66.55 -6.5 15.27 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . -58.23 -58.1 16.35 Favored Glycine 0 CA--C 1.532 1.113 0 N-CA-C 110.349 -1.1 . . . . 0.0 110.349 167.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' VAL . . . . . . . . . . . . . 59.4 t -67.83 129.75 32.59 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 174.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ARG . . . . . . . . . . . . . 97.4 mtt180 -139.41 158.05 44.8 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.286 0.634 . . . . 0.0 110.429 179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -62.41 -35.42 79.16 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.897 1.679 . . . . 0.0 109.935 167.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -49.93 -43.26 49.77 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 126.331 1.852 . . . . 0.0 111.357 170.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' ARG . . . . . . . . . . . . . 3.4 ttm180 52.8 34.53 16.56 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.341 1.856 . . . . 0.0 114.16 164.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' VAL . . . . . . . . . . . . . 11.9 m -68.98 125.03 26.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . 0.468 ' CZ ' ' HA ' ' A' ' 179' ' ' ARG . 0.0 OUTLIER -70.65 155.8 40.27 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.364 0.602 . . . . 0.0 111.488 -169.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLY . . . . . . . . . . . . . . . 71.9 -84.67 0.48 Allowed Glycine 0 CA--C 1.522 0.497 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 -167.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' GLY . . . . . . . . . . . . . . . 52.68 52.55 37.58 Favored Glycine 0 CA--C 1.532 1.108 0 C-N-CA 124.517 1.056 . . . . 0.0 112.454 170.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' ARG . . . . . . . . . . . . . 70.4 mtp85 -60.71 112.06 1.87 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.309 1.444 . . . . 0.0 109.788 -168.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -71.32 147.49 48.03 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 123.793 0.837 . . . . 0.0 110.013 172.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -149.92 104.37 3.3 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 167.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -69.09 148.8 49.47 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 122.776 0.43 . . . . 0.0 110.093 175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 99.6 mttt . . . . . 0 C--O 1.237 0.445 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.801 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.168 1 O4'-C1'-N19 111.359 4.449 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.877 0 P-O3'-C3' 123.401 3.084 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.611 0 P-O3'-C3' 123.302 3.001 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.621 1 O4'-C1'-N19 111.646 4.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.806 1 O4'-C1'-N19 111.362 4.453 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.043 1 O4'-C1'-N19 111.732 4.915 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.411 -3.203 0 C3'-C2'-C1' 106.654 2.824 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.541 3.783 0 O5'-C5'-C4' 114.324 2.946 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.765 0 O4'-C1'-N19 110.379 3.224 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 1 C5'--C4' 1.544 4.102 1 O4'-C1'-N19 112.721 6.152 . . . . 0.0 . . . . . . . . . . 2 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.302 1 O4'-C1'-N19 112.867 6.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.379 0 O4'-C1'-N19 110.675 3.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.262 0 O4'-C1'-N19 110.662 3.578 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.543 3.974 1 O4'-C1'-N19 111.735 4.919 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.538 3.355 0 O4'-C1'-N19 110.988 3.985 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.565 2 P-O3'-C3' 124.81 4.259 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.535 3.002 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.542 3.865 1 O4'-C1'-N19 111.27 4.337 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.092 1 O4'-C1'-N19 113.294 6.867 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.533 2.776 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.461 0 O4'-C4'-C3' 108.664 3.064 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.415 -2.78 0 O4'-C1'-N19 110.229 3.037 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 23' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.416 -2.736 0 O4'-C4'-C3' 108.397 2.797 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.536 3.077 1 O4'-C1'-N19 111.05 4.062 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 25' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.534 2.851 0 O4'-C1'-N19 110.39 3.237 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.537 3.209 1 O4'-C1'-N19 111.512 4.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_